SCHEMBL3950992

SCHEMBL3950992

CCOc1cc(N2CCOCC2)ccc1Nc1nc(Nc2ccccc2S(C)(=O)=O)c2cn[nH]c2n1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ZAP70 P43403 2/20 0.63
▸ FES P07332 1/20 0.61
▸ FLT3 P36888 1/20 0.61
▸ TTK P33981 5/20 0.58
▸ ULK1 O75385 1/20 0.55
▸ PTK2 Q05397 4/20 0.51
▸ LRRK2 Q5S007 2/20 0.51
▸ EGFR P00533 1/20 0.51
▸ ALK Q9UM73 3/20 0.51
▸ GSK3A P49840 1/20 0.51
▸ MAPK15 Q8TD08 1/20 0.51
▸ CAMKK2 Q96RR4 1/20 0.51
▸ MAP4K1 Q92918 1/20 0.50
▸ INSR P06213 1/20 0.50
▸ IGF1R P08069 1/20 0.50

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
SCHEMBL18018885 0.86 ZAP70 (0.62) ZAP70TTKULK1PTK2LRRK2
SCHEMBL3958582 0.83 FES (0.87) ZAP70FESFLT3TTKULK1
SCHEMBL3952918 0.83 ZAP70 (0.67) ZAP70FESFLT3TTKULK1
SCHEMBL3954360 0.82 FES (0.86) ZAP70FESFLT3TTKULK1
SCHEMBL29720306 0.82 FES (0.72) ZAP70FESFLT3TTKULK1
SCHEMBL4051190 0.82 FES (0.72) ZAP70FESFLT3TTKULK1
SCHEMBL3959984 0.81 FES (0.80) ZAP70FESFLT3TTKULK1
SCHEMBL3950201 0.80 FES (0.66) ZAP70FESFLT3TTKULK1
SCHEMBL3952863 0.80 ALK (0.75) ZAP70FESFLT3TTKULK1
SCHEMBL12781486 0.79 ULK1 (0.85) ZAP70FESFLT3ULK1PTK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009032694-A1 AMINO SUBSTITUTED PYRIMIDINE, PYROLLOPYRIDINE AND PYRAZOLOPYRIMIDINE DERIVATIVES USEFUL AS KINASE INHIBITORS AND IN TREATING PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS DANA FARBER CANCER INSTITUTE (US) 2009-03-12 — — WO claimed
WO-2009032703-A1 2- (HET) ARYLAMINO-6-AMINOPYRIDINE DERIVATIVES AND FUSED FORMS THEREOF AS ANAPLASTIC LYMPHOMA KINASE INHIBITORS IRM LLC (BM) 2009-03-12 — — WO disclosed
WO-2009032703-A1 2- (HET) ARYLAMINO-6-AMINOPYRIDINE DERIVATIVES AND FUSED FORMS THEREOF AS ANAPLASTIC LYMPHOMA KINASE INHIBITORS IRM LLC (BM) 2009-03-12 — — WO disclosed
WO-2009032694-A1 AMINO SUBSTITUTED PYRIMIDINE, PYROLLOPYRIDINE AND PYRAZOLOPYRIMIDINE DERIVATIVES USEFUL AS KINASE INHIBITORS AND IN TREATING PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS DANA FARBER CANCER INSTITUTE (US) 2009-03-12 — — WO disclosed
WO-2009032694-A1 AMINO SUBSTITUTED PYRIMIDINE, PYROLLOPYRIDINE AND PYRAZOLOPYRIMIDINE DERIVATIVES USEFUL AS KINASE INHIBITORS AND IN TREATING PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS DANA FARBER CANCER INSTITUTE (US) 2009-03-12 — — WO disclosed
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