SCHEMBL2386955

SCHEMBL2386955

CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/C[N+](C)(C)C

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 13/20 0.83
ERBB2 P04626 10/20 0.83
STK3 Q13188 6/20 0.83
STK4 Q13043 5/20 0.83
SRC P12931 2/20 0.83
KDR P35968 2/20 0.83
BTK Q06187 2/20 0.83
STK25 O00506 1/20 0.83
MAP2K7 O14733 1/20 0.83
CHEK1 O14757 1/20 0.83
GAK O14976 1/20 0.83
EPHB6 O15197 1/20 0.83
ABCC4 O15439 1/20 0.83
MAP3K13 O43283 1/20 0.83
NUAK1 O60285 1/20 0.83
STK17B O94768 1/20 0.83
STK10 O94804 1/20 0.83
PRKD3 O94806 1/20 0.83
ABCB11 O95342 1/20 0.83
MAP4K4 O95819 1/20 0.83

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29801718 1.00 EGFR (0.83) EGFRERBB2STK3STK4SRC
SCHEMBL2386963 1.00 EGFR (0.83) EGFRERBB2STK3STK4SRC
SCHEMBL5020000 0.95 EGFR (0.83) EGFRERBB2STK3STK4SRC
SCHEMBL4540604 0.95 EGFR (0.82) EGFRERBB2STK3STK4SRC
SCHEMBL4540611 0.95 EGFR (0.82) EGFRERBB2STK3STK4SRC
SCHEMBL17570820 0.94 EGFR (0.88) EGFRERBB2STK3STK4SRC
SCHEMBL18780473 0.93 EGFR (0.87) EGFRERBB2STK3STK4SRC
SCHEMBL31661612 0.93 EGFR (0.87) EGFRERBB2STK3STK4SRC
SCHEMBL30185817 0.92 EGFR (0.85) EGFRERBB2STK3STK4SRC
SCHEMBL28970453 0.92 EGFR (0.85) EGFRERBB2STK3STK4SRC

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260092046-A1 MALEATE SALTS OF (E)-N-{4-[3-CHLORO-4-(2-PYRIDINYLMETHOXY)ANILINO]-3-CYANO-7-ETHOXY-6-QUINOLINYL}-4-(DIMETHYLAMINO)-2-BUTENAMIDE AND CRYSTALLINE FORMS THEREOF WYETH LLC (US) 2026-04-02 US disclosed
US-10035788-B2 Maleate salts of (E)-N-{4[3-chloro-4-(2-pyridinylmethoxy)anilino]-3-cyano-7-ethoxy-6-quinolinyl}-4-(dimethylamino)-2-butenamide and crystalline forms thereof WYETH LLC (US) 2018-07-31 US disclosed
US-10035788-B2 Maleate salts of (E)-N-{4[3-chloro-4-(2-pyridinylmethoxy)anilino]-3-cyano-7-ethoxy-6-quinolinyl}-4-(dimethylamino)-2-butenamide and crystalline forms thereof WYETH LLC (US) 2018-07-31 US disclosed
US-20170320852-A1 MALEATE SALTS OF (E)-N--4-(DIMETHYLAMINO)-2-BUTENAMIDE AND CRYSTALLINE FORMS THEREOF WYETH LLC 2017-11-09 US disclosed
US-20170320852-A1 MALEATE SALTS OF (E)-N--4-(DIMETHYLAMINO)-2-BUTENAMIDE AND CRYSTALLINE FORMS THEREOF WYETH LLC 2017-11-09 US disclosed
US-9630946-B2 Maleate salts of (E)-N-{4-[3-chloro-4-(2-pyridinylmethoxy)anilino]-3-cyano-7-ethoxy-6-quinolinyl}-4-(dimethylamino)-2-butenamide and crystalline forms thereof WYETH LLC (US) 2017-04-25 US disclosed
US-9630946-B2 Maleate salts of (E)-N-{4-[3-chloro-4-(2-pyridinylmethoxy)anilino]-3-cyano-7-ethoxy-6-quinolinyl}-4-(dimethylamino)-2-butenamide and crystalline forms thereof WYETH LLC (US) 2017-04-25 US disclosed
EP-2626353-B1 Maleate salts of (E)-N-{4-[3-chloro-4-(2-pyridinylmethoxy)anilino]-3-cyano-7-ethoxy-6-quinolinyl}-4-(dimethylamino)-2-butenamide and crystalline forms thereof WYETH LLC (US) 2016-11-23 EP disclosed
EP-2626353-B1 Maleate salts of (E)-N-{4-[3-chloro-4-(2-pyridinylmethoxy)anilino]-3-cyano-7-ethoxy-6-quinolinyl}-4-(dimethylamino)-2-butenamide and crystalline forms thereof WYETH LLC (US) 2016-11-23 EP disclosed
EP-3088398-A1 MALEATE SALTS OF (E)-N-{4-[3-CHLORO-4-(2-PYRIDINYLMETHOXY)ANILINO]-3-CYANO-7-ETHOXY-6-QUINOLINYL}-4-(DIMETHYLAMINO)-2-BUTENAMIDE AND CRYSTALLINE FORMS THEREOF Wyeth LLC (US) 2016-11-02 EP disclosed
US-8173814-B2 Maleate salts of (E)-N-{4-[3-chloro-4-(2-pyridinylmethoxy)anilino]-3-cyano-7-ethoxy-6-quinolinyl}-4-(dimethylamino)-2-butenamide and crystalline forms thereof WYETH LLC (US) 2012-05-08 US disclosed
US-8022216-B2 Maleate salts of (E)-N-{4-[3-chloro-4-(2-pyridinylmethoxy)anilino]-3-cyano-7-ethoxy-6-quinolinyl}-4-(dimethylamino)-2-butenamide and crystalline forms thereof WYETH LLC (US) 2011-09-20 US disclosed
US-8022216-B2 Maleate salts of (E)-N-{4-[3-chloro-4-(2-pyridinylmethoxy)anilino]-3-cyano-7-ethoxy-6-quinolinyl}-4-(dimethylamino)-2-butenamide and crystalline forms thereof WYETH LLC (US) 2011-09-20 US disclosed
EP-2258698-A2 Maleate salts of (E)-N-{4-[3-chloro-4-(2-pyridinylmethoxy)anilino]-3-cyano-7-ethoxy-6-quinolinyl}-4-(dimethylamino)-2-butenamide and crystalline forms thereof Wyeth LLC (US) 2010-12-08 EP disclosed
EP-2258698-A2 Maleate salts of (E)-N-{4-[3-chloro-4-(2-pyridinylmethoxy)anilino]-3-cyano-7-ethoxy-6-quinolinyl}-4-(dimethylamino)-2-butenamide and crystalline forms thereof Wyeth LLC (US) 2010-12-08 EP disclosed
EP-2212311-A2 MALEATE SALTS OF (E)-N-{4-Ý3-CHLORO-4-(2-PYRIDINYLMETHOXY)ANILINO¨-3-CYANO-7-ETHOXY-6-QUINOLINYL}-4-(DIMETHYLAMINO)-2-BUTENAMIDE AND CRYSTALLINE FORMS THEREOF Wyeth LLC (US) 2010-08-04 EP disclosed
US-20090176827-A1 MALEATE SALTS OF (E)-N--4-(DIMETHYLAMINO)-2-BUTENAMIDE AND CRYSTALLINE FORMS THEREOF WYETH (US) 2009-07-09 US disclosed
US-20090176827-A1 MALEATE SALTS OF (E)-N--4-(DIMETHYLAMINO)-2-BUTENAMIDE AND CRYSTALLINE FORMS THEREOF WYETH (US) 2009-07-09 US disclosed
WO-2009052264-A2 MALEATE SALTS OF (E)-N-{4-[3-CHLORO-4-(2-PYRIDINYLMETHOXY)ANILINO]-3-CYANO-7-ETHOXY-6-QUINOLINYL}-4-(DIMETHYLAMINO)-2-BUTENAMIDE AND CRYSTALLINE FORMS THEREOF WYETH (US) 2009-04-23 WO disclosed
WO-2009052264-A2 MALEATE SALTS OF (E)-N-{4-[3-CHLORO-4-(2-PYRIDINYLMETHOXY)ANILINO]-3-CYANO-7-ETHOXY-6-QUINOLINYL}-4-(DIMETHYLAMINO)-2-BUTENAMIDE AND CRYSTALLINE FORMS THEREOF WYETH (US) 2009-04-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170320852-A1 MALEATE SALTS OF (E)-N--4-(DIMETHYLAMINO)-2-BUTENAMIDE AND CRYSTALLINE FORMS THEREOF EGFR, ERBB4, ALK EGFR 1/4885ERBB2 7/4885STK3 392/4885
US-10035788-B2 Maleate salts of (E)-N-{4[3-chloro-4-(2-pyridinylmethoxy)anilino]-3-cyano-7-ethoxy-6-quinolinyl}-4-(dimethylamino)-2-butenamide and crystalline forms thereof EGFR, ERBB4, ERBB3 EGFR 1/4885ERBB2 4/4885STK3 436/4885
US-20260092046-A1 MALEATE SALTS OF (E)-N-{4-[3-CHLORO-4-(2-PYRIDINYLMETHOXY)ANILINO]-3-CYANO-7-ETHOXY-6-QUINOLINYL}-4-(DIMETHYLAMINO)-2-BUTENAMIDE AND CRYSTALLINE FORMS THEREOF EGFR, MET, ERBB2 EGFR 1/4885ERBB2 3/4885STK3 570/4885
US-20090176827-A1 MALEATE SALTS OF (E)-N--4-(DIMETHYLAMINO)-2-BUTENAMIDE AND CRYSTALLINE FORMS THEREOF EGFR, ERBB4, ALK EGFR 1/4885ERBB2 4/4885STK3 367/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.