SCHEMBL905672

SCHEMBL905672

Cc1[nH]c(C=C2C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCCN(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 1.00
PDGFRB P09619 10/20 1.00
PRKAA1 Q13131 9/20 1.00
PRKAA2 P54646 8/20 1.00
FGFR1 P11362 5/20 1.00
CSF1R P07333 3/20 0.84
TLK2 Q86UE8 3/20 0.84
PLK4 O00444 2/20 0.84
DCLK1 O15075 2/20 0.84
PDPK1 O15530 2/20 0.84
DAPK3 O43293 2/20 0.84
ROCK2 O75116 2/20 0.84
RPS6KA5 O75582 2/20 0.84
RPS6KA4 O75676 2/20 0.84
MAP4K4 O95819 2/20 0.84
CHEK2 O96017 2/20 0.84
NTRK1 P04629 2/20 0.84
INSR P06213 2/20 0.84
LCK P06239 2/20 0.84
FYN P06241 2/20 0.84

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
SCHEMBL29856494 1.00 KDR (1.00) KDRPDGFRBPRKAA1PRKAA2FGFR1
SCHEMBL905668 1.00 KDR (1.00) KDRPDGFRBPRKAA1PRKAA2FGFR1
SCHEMBL29856539 0.95 PRKAA1 (1.00) KDRPDGFRBPRKAA1PRKAA2FGFR1
SCHEMBL27275642 0.95 PRKAA1 (1.00) KDRPDGFRBPRKAA1PRKAA2FGFR1
SCHEMBL15459734 0.92 KDR (0.85) KDRPDGFRBPRKAA1PRKAA2FGFR1
Sunitinib SCHEMBL25343938 0.91 KDR (1.00) KDRPDGFRBPRKAA1PRKAA2FGFR1
Sunitinib SCHEMBL20805212 0.91 KDR (1.00) KDRPDGFRBPRKAA1PRKAA2FGFR1
Sunitinib SCHEMBL30314241 0.91 KDR (1.00) KDRPDGFRBPRKAA1PRKAA2FGFR1
Sunitinib SCHEMBL25343935 0.91 KDR (1.00) KDRPDGFRBPRKAA1PRKAA2FGFR1
Sunitinib SCHEMBL8082 0.91 KDR (1.00) KDRPDGFRBPRKAA1PRKAA2FGFR1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111298127-A Composition comprising histamine release-promoting substance and inhibitory compound, and oral solid preparation containing the same 黄泳华 2020-06-19 CN claimed
CN-111298127-A Composition comprising histamine release-promoting substance and inhibitory compound, and oral solid preparation containing the same 黄泳华 2020-06-19 CN disclosed
EP-2277595-A2 Compounds for immunopotentiation Novartis Vaccines and Diagnostics, Inc. (US) 2011-01-26 EP disclosed
US-20100226931-A1 Compounds for immunopotentiation NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2010-09-09 US disclosed
EP-1765313-A2 COMPOUNDS FOR IMMUNOPOTENTIATION Novartis Vaccines and Diagnostics, Inc. (US) 2007-03-28 EP disclosed
WO-2006002422-A9 COMPOUNDS FOR IMMUNOPOTENTIATION CHIRON CORP (US) 2006-09-21 WO disclosed
WO-2006002422-A2 COMPOUNDS FOR IMMUNOPOTENTIATION NOVARTIS VACCINES AND DIAGNOSTICS INC. (US) 2006-01-05 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 (1 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-20100226931-A1 Compounds for immunopotentiation LY96, ICOS, PDCD1 KDR 2584/4885PDGFRB 3406/4885PRKAA1 950/4885

“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.