Su-014813

Su-014813

SCHEMBL3367367

Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.93

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

FLT1FLT3FLT4KDRKITPDGFRAPDGFRB

The experimentally established mechanism targets of Su-014813. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR known ✓ P35968 12/20 0.93
PDGFRB known ✓ P09619 11/20 0.93
KIT known ✓ P10721 4/20 0.93
FLT1 known ✓ P17948 3/20 0.93
FLT4 known ✓ P35916 3/20 0.93
FLT3 known ✓ P36888 3/20 0.93
PDGFRA known ✓ P16234 2/20 0.93
PRKAA1 Q13131 8/20 0.93
FGFR1 P11362 7/20 0.93
PRKAA2 P54646 7/20 0.93
TLK2 Q86UE8 5/20 0.93
RIOK2 Q9BVS4 3/20 0.93
TLK1 Q9UKI8 3/20 0.93
RIPK1 Q13546 3/20 0.93
PLK4 O00444 3/20 0.93
DCLK1 O15075 3/20 0.93
PDPK1 O15530 3/20 0.93
DAPK3 O43293 3/20 0.93
ROCK2 O75116 3/20 0.93
RPS6KA5 O75582 3/20 0.93

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
Su-014813 SCHEMBL3367375 1.00 KDR (0.93) KDRPDGFRBPRKAA1FGFR1PRKAA2
Su-014813 SCHEMBL30030129 1.00 KDR (0.93) KDRPDGFRBPRKAA1FGFR1PRKAA2
Su-014813 SCHEMBL902507 0.96 KDR (1.00) KDRPDGFRBPRKAA1FGFR1PRKAA2
Su-014813 SCHEMBL2334599 0.96 KDR (1.00) KDRPDGFRBPRKAA1FGFR1PRKAA2
Su-014813 SCHEMBL4500929 0.96 KDR (1.00) KDRPDGFRBPRKAA1FGFR1PRKAA2
Su-014813 SCHEMBL2334610 0.96 KDR (1.00) KDRPDGFRBPRKAA1FGFR1PRKAA2
Su-014813 SCHEMBL4500940 0.96 KDR (1.00) KDRPDGFRBPRKAA1FGFR1PRKAA2
Su-014813 SCHEMBL1249521 0.96 KDR (1.00) KDRPDGFRBPRKAA1FGFR1PRKAA2
SCHEMBL13711974 0.89 PDGFRB (0.86) KDRPDGFRBPRKAA1FGFR1PRKAA2
SCHEMBL6726631 0.88 PDGFRB (0.83) KDRPDGFRBPRKAA1FGFR1PRKAA2

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
US-20100317715-A1 METHODS FOR TREATING NEUROPSYCHIATRIC CONDITIONS AFRAXIS HOLDINGS, INC. 2010-12-16 US disclosed
EP-1670785-B1 SALTS AND POLYMORPHS OF A PYRROLE-SUBSTITUTED INDOLINONE COMPOUND PHARMACIA & UPJOHN CO LLC (US) 2010-07-07 EP disclosed
US-7247627-B2 non-hygroscopic, crystalline anhydrous maleate salt of 5-[(Z)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene) methyl]-N-[(2S)-2-hydroxy-3-morpholin-4-ylpropyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide PHARMACIA & UPJOHN COMPANY (US) 2007-07-24 US disclosed
EP-1670785-A1 SALTS AND POLYMORPHS OF A PYRROLE-SUBSTITUTED INDOLINONE COMPOUND Pharmacia & Upjohn Company LLC (US) 2006-06-21 EP disclosed
WO-2005033098-A9 Salts and polymorphs of a pyrrole-substituted indolinone compound PHARMACIA & UPJOHN CO LLC (US) 2006-05-26 WO disclosed
US-20050118255-A1 non-hygroscopic, crystalline anhydrous maleate salt of 5-[(Z)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene) methyl]-N-[(2S)-2-hydroxy-3-morpholin-4-ylpropyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide BLASKO ANDREI (US) 2005-06-02 US disclosed
WO-2005033098-A1 SALTS AND POLYMORPHS OF A PYRROLE-SUBSTITUTED INDOLINONE COMPOUND PHARMACIA & UPJOHN COMPANY LLC (US) 2005-04-14 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 (2 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-20100317715-A1 METHODS FOR TREATING NEUROPSYCHIATRIC CONDITIONS GRM5, GRIK5, PAK5 KDR 4812/4885PDGFRB 3065/4885KIT 4475/4885
US-20050118255-A1 non-hygroscopic, crystalline anhydrous maleate salt of 5-[(Z)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene) methyl]-N-[(2S)-2-hydroxy-3-morpholin-4-ylpropyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, SLC5A11, INF2 KDR 3323/4885PDGFRB 4295/4885KIT 3337/4885

“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.