SCHEMBL589290

SCHEMBL589290

Cc1n[nH]c2cc(N(C)c3nc(N)ncc3-c3cccc(CS(=O)(=O)C(C)C)c3)ccc12

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HAO1 Q9UJM8 3/20 0.34
AAK1 Q2M2I8 4/20 0.32
GAK O14976 3/20 0.32
STK16 O75716 3/20 0.32
BMP2K Q9NSY1 3/20 0.32
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
SGK1 O00141 2/20 0.31
CDKL2 Q92772 1/20 0.31
KDR P35968 2/20 0.31
FGFR1 P11362 1/20 0.31
LRRK2 Q5S007 1/20 0.31
FYN P06241 1/20 0.30
ADORA1 P30542 1/20 0.30

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
SCHEMBL589060 0.92 SGK1 (0.34) ALOX5APFEN1SGK1KDR
SCHEMBL589706 0.79 JAK2 (0.43) SGK1KDRLRRK2
SCHEMBL2867774 0.76 PAK1 (0.42) KDR
SCHEMBL31672454 0.76 PAK1 (0.42) KDR
SCHEMBL589152 0.74 TUBB3 (0.32)
SCHEMBL10151180 0.73 KDR (0.54) KDR
SCHEMBL31672434 0.73 KDR (0.54) KDR
SCHEMBL589166 0.72 LRRK2 (0.36) SGK1LRRK2
SCHEMBL589780 0.72 BRD4 (0.36)
SCHEMBL10151181 0.71 KDR (0.49) AAK1GAKSTK16BMP2KKDR

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 20 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-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-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-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-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 HAO1 1576/4885AAK1 400/4885GAK 639/4885
US-20070015756-A1 Chemical compounds KDR, FLT4, FLT1 HAO1 1834/4885AAK1 874/4885GAK 297/4885
US-20100105712-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 HAO1 1834/4885AAK1 874/4885GAK 297/4885
US-20180000771-A1 AGENT FOR PREVENTING AND/OR TREATING AMYOTROPHIC LATERAL SCLEROSIS WEE2, WEE1, ERBB2 HAO1 1054/4885AAK1 525/4885GAK 183/4885
US-20120277258-A1 Chemical Compounds KDR, FLT4, FLT1 HAO1 1834/4885AAK1 874/4885GAK 297/4885
US-20070270427-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 HAO1 1834/4885AAK1 874/4885GAK 297/4885
US-20070292513-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 HAO1 1834/4885AAK1 874/4885GAK 297/4885

“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.