SCHEMBL10151177

SCHEMBL10151177

CCS(=O)(=O)c1ccc(OC)c(Nc2nccc(N(C)c3ccc4c(C)n[nH]c4c3)n2)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 0.47
PARP1 P09874 3/20 0.46
CYP3A4 P08684 4/20 0.44
CYP2D6 P10635 4/20 0.44
CYP2C9 P11712 4/20 0.44
CYP2C19 P33261 4/20 0.44
ABCB11 O95342 2/20 0.39
FLT1 P17948 6/20 0.39
FLT4 P35916 6/20 0.39
CLK1 P49759 2/20 0.38
DYRK1A Q13627 2/20 0.38
CCNT1 O60563 1/20 0.38
GSK3A P49840 1/20 0.38
GSK3B P49841 1/20 0.38
CDK9 P50750 1/20 0.38
KIT P10721 2/20 0.38
PDGFRA P16234 2/20 0.38
BMPR1B O00238 1/20 0.37
PLK4 O00444 1/20 0.37
AURKA O14965 1/20 0.37

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
SCHEMBL31672398 1.00 KDR (0.47) KDRPARP1CYP3A4CYP2D6CYP2C9
SCHEMBL31672413 0.93 KDR (0.47) KDRPARP1CYP3A4CYP2D6CYP2C9
SCHEMBL10151221 0.93 KDR (0.47) KDRPARP1CYP3A4CYP2D6CYP2C9
SCHEMBL588517 0.92 KDR (0.53) KDRPARP1CYP3A4CYP2D6CYP2C9
SCHEMBL30453672 0.92 KDR (0.53) KDRPARP1CYP3A4CYP2D6CYP2C9
SCHEMBL2874945 0.91 KDR (0.40) KDRPARP1FLT1FLT4CLK1
SCHEMBL31672520 0.91 KDR (0.40) KDRPARP1FLT1FLT4CLK1
SCHEMBL589264 0.91 KDR (0.46) KDRPARP1CYP3A4CYP2D6CYP2C9
SCHEMBL30453307 0.91 KDR (0.46) KDRPARP1CYP3A4CYP2D6CYP2C9
SCHEMBL31672515 0.90 KDR (0.46) KDRPARP1CYP3A4CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2311825-B1 Pyrimidineamines as angiogenesis modulators NOVARTIS AG (CH) 2015-10-07 EP claimed
EP-2311825-B1 Pyrimidineamines as angiogenesis modulators NOVARTIS AG (CH) 2015-10-07 EP disclosed
US-20120277258-A1 Chemical Compounds LEO OSPREY LIMITED (JE) 2012-11-01 US disclosed
US-8114885-B2 Pazopanib hydrochloride and synthesis, chemical intermediates, and dosage forms thereof; anticancer; colon cancer, breast cancer GLAXOSMITHKLINE LLC (US) 2012-02-14 US disclosed
US-7858626-B2 Pyrimidineamines as angiogenesis modulators GLAXOSMITHKLINE LLC (US) 2010-12-28 US disclosed
US-20100105712-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2010-04-29 US disclosed
US-20070292513-A1 CHEMICAL COMPOUNDS NOVARTIS AG (CH) 2007-12-20 US disclosed
US-20070292513-A1 CHEMICAL COMPOUNDS NOVARTIS AG (CH) 2007-12-20 US disclosed
US-20070270427-A1 CHEMICAL COMPOUNDS NOVARTIS AG (CH) 2007-11-22 US disclosed
US-20070270427-A1 CHEMICAL COMPOUNDS NOVARTIS AG (CH) 2007-11-22 US disclosed
US-7262203-B2 Pyrimidineamines as angiogenesis modulators SMITHKLINE BEECHAM CORPORATION (US) 2007-08-28 US disclosed
US-7262203-B2 Pyrimidineamines as angiogenesis modulators SMITHKLINE BEECHAM CORPORATION (US) 2007-08-28 US disclosed
US-20070015756-A1 Chemical compounds NOVARTIS AG (CH) 2007-01-18 US disclosed
US-20070015756-A1 Chemical compounds NOVARTIS AG (CH) 2007-01-18 US 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 (5 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-20070015756-A1 Chemical compounds KDR, FLT4, FLT1 KDR 1/4885PARP1 148/4885CYP3A4 2882/4885
US-20100105712-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 KDR 1/4885PARP1 148/4885CYP3A4 2882/4885
US-20120277258-A1 Chemical Compounds KDR, FLT4, FLT1 KDR 1/4885PARP1 148/4885CYP3A4 2882/4885
US-20070270427-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 KDR 1/4885PARP1 148/4885CYP3A4 2882/4885
US-20070292513-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 KDR 1/4885PARP1 148/4885CYP3A4 2882/4885

“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.