SCHEMBL7832595

SCHEMBL7832595

COc1ccccc1-c1ccc2c(c1)NC(=O)C2=Cc1cnc[nH]1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLK2 Q86UE8 8/20 0.67
▸ CDK5 Q00535 3/20 0.64
▸ MAPT P10636 2/20 0.64
▸ CDK5R1 Q15078 2/20 0.64
▸ SMN1; SMN2 Q16637 2/20 0.64
▸ PTK2B Q14289 1/20 0.64
▸ KDR P35968 5/20 0.62
▸ PDGFRB P09619 4/20 0.62
▸ FGFR1 P11362 4/20 0.62
▸ CHEK1 O14757 3/20 0.59
▸ CDK1 P06493 2/20 0.59
▸ RET P07949 2/20 0.59
▸ CDK2 P24941 2/20 0.59
▸ MAPK1 P28482 2/20 0.59
▸ GSK3A P49840 2/20 0.59
▸ GSK3B P49841 2/20 0.59
▸ CDK7 P50613 2/20 0.59
▸ CDK9 P50750 2/20 0.59
▸ CHEK2 O96017 2/20 0.59
▸ NTRK1 P04629 2/20 0.59

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
SCHEMBL7828051 0.84 TLK2 (0.72) TLK2CDK5MAPTCDK5R1SMN1; SMN2
SCHEMBL8185332 0.83 TLK2 (0.68) TLK2CDK5MAPTCDK5R1SMN1; SMN2
SCHEMBL29476105 0.79 TLK2 (1.00) TLK2CDK5MAPTCDK5R1SMN1; SMN2
SCHEMBL12722125 0.77 TLK2 (0.67) TLK2CDK5MAPTCDK5R1SMN1; SMN2
SCHEMBL7834368 0.77 PDGFRB (1.00) MAPTSMN1; SMN2KDRPDGFRBFGFR1
SCHEMBL7834370 0.77 PDGFRB (1.00) MAPTSMN1; SMN2KDRPDGFRBFGFR1
SCHEMBL8192156 0.77 KDR (0.59) TLK2CDK5MAPTCDK5R1SMN1; SMN2
SCHEMBL14521208 0.76 NPC1 (0.62) MAPTSMN1; SMN2KDRPDGFRBFGFR1
Su-9516 SCHEMBL1170686 0.74 TLK2 (1.00) TLK2CDK5MAPTCDK5R1SMN1; SMN2
Su-9516 SCHEMBL1170687 0.74 TLK2 (1.00) TLK2CDK5MAPTCDK5R1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066257-A2 HETEROCYLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE Sugen, Inc. (US) 2001-01-10 — — EP disclosed
WO-1999048868-A2 HETEROCYCLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE SUGEN, INC. (US) 1999-09-30 — — WO disclosed
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