SCHEMBL589156

SCHEMBL589156

Cc1n[nH]c2cc(N(C)c3nc(Nc4ccc(N(C)S(C)(=O)=O)cc4)ncc3F)ccc12

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PAK1 Q13153 6/20 0.42
PTK2 Q05397 12/20 0.38
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
KDR P35968 1/20 0.36

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
SCHEMBL31672493 0.91 PAK1 (0.48) PAK1CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL2873675 0.91 PAK1 (0.48) PAK1CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL589261 0.89 CDK2 (0.44) PAK1PTK2CYP3A4CYP2D6CYP2C9
SCHEMBL30454614 0.89 CDK2 (0.44) PAK1PTK2CYP3A4CYP2D6CYP2C9
SCHEMBL589155 0.86 PAK1 (0.41) PAK1KDR
SCHEMBL589781 0.85 PAK1 (0.43) PAK1CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL6993408 0.85 PAK1 (0.40) PAK1CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL31672441 0.84 KDR (0.46) PAK1CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL2877133 0.84 KDR (0.46) PAK1CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL5367911 0.82 PAK1 (0.46) PAK1PTK2CYP3A4CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2311825-A1 Pyrimidineamines as angiogenesis modulators GlaxoSmithKline LLC (US) 2011-04-20 EP claimed
US-7262203-B2 Pyrimidineamines as angiogenesis modulators SMITHKLINE BEECHAM CORPORATION (US) 2007-08-28 US claimed
US-20070015756-A1 Chemical compounds NOVARTIS AG (CH) 2007-01-18 US claimed
US-20040242578-A1 Pyrimidineamines as angiogenesis modulators NOVARTIS AG (CH) 2004-12-02 US claimed
EP-4599890-A2 SUNITINIB FOR PREVENTING AND/OR TREATING AMYOTROPHIC LATERAL SCLEROSIS Kyoto University (JP) 2025-08-13 EP disclosed
EP-3789027-A1 BOSUTINIB, SUNITINIB, TIVOZANIB, IMATINIB, NILOTINIB, REBASTINIB OR BAFETINIB FOR PREVENTING AND/OR TREATING AMYOTROPHIC LATERAL SCLEROSIS KYOTO UNIVERSITY (JP) 2021-03-10 EP disclosed
US-20180000771-A1 AGENT FOR PREVENTING AND/OR TREATING AMYOTROPHIC LATERAL SCLEROSIS KYOTO UNIVERSITY (JP) 2018-01-04 US disclosed
EP-3246046-A1 AGENT FOR PREVENTING AND/OR TREATING AMYOTROPHIC LATERAL SCLEROSIS Kyoto University (JP) 2017-11-22 EP disclosed
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
EP-2311825-A1 Pyrimidineamines as angiogenesis modulators GlaxoSmithKline LLC (US) 2011-04-20 EP disclosed
US-20100105712-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2010-04-29 US disclosed
EP-1343782-B1 PYRIMIDINEAMINES AS ANGIOGENESIS MODULATORS SMITHKLINE BEECHAM CORP (US) 2009-05-06 EP 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-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-7105530-B2 inhibitors of vascular endothelial growth factor receptor-2 kinase; pazopanib and salts; for proliferative retinopathy; anticancer SMITHKLINE BEECHAM CORPORATION (US) 2006-09-12 US disclosed
US-20040242578-A1 Pyrimidineamines as angiogenesis modulators NOVARTIS AG (CH) 2004-12-02 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 (7 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-20040242578-A1 Pyrimidineamines as angiogenesis modulators TYMS, TYMP, DPYD PAK1 969/4885PTK2 1983/4885CYP3A4 3720/4885
US-20070015756-A1 Chemical compounds KDR, FLT4, FLT1 PAK1 189/4885PTK2 616/4885CYP3A4 2882/4885
US-20100105712-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 PAK1 189/4885PTK2 616/4885CYP3A4 2882/4885
US-20180000771-A1 AGENT FOR PREVENTING AND/OR TREATING AMYOTROPHIC LATERAL SCLEROSIS WEE2, WEE1, ERBB2 PAK1 573/4885PTK2 115/4885CYP3A4 1754/4885
US-20120277258-A1 Chemical Compounds KDR, FLT4, FLT1 PAK1 189/4885PTK2 616/4885CYP3A4 2882/4885
US-20070270427-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 PAK1 189/4885PTK2 616/4885CYP3A4 2882/4885
US-20070292513-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 PAK1 189/4885PTK2 616/4885CYP3A4 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.