SCHEMBL7828051

SCHEMBL7828051

COc1ccc(-c2ccc3c(c2)NC(=O)C3=Cc2cnc[nH]2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLK2 Q86UE8 11/20 0.72
▸ CDK5 Q00535 3/20 0.72
▸ KDR P35968 3/20 0.72
▸ PDGFRB P09619 3/20 0.72
▸ CDK1 P06493 2/20 0.72
▸ RET P07949 2/20 0.72
▸ CDK2 P24941 2/20 0.72
▸ MAPK1 P28482 2/20 0.72
▸ GSK3A P49840 2/20 0.72
▸ GSK3B P49841 2/20 0.72
▸ CDK7 P50613 2/20 0.72
▸ CDK9 P50750 2/20 0.72
▸ MAPT P10636 2/20 0.72
▸ CDK5R1 Q15078 2/20 0.72
▸ SMN1; SMN2 Q16637 2/20 0.72
▸ FGFR1 P11362 2/20 0.72
▸ CHEK1 O14757 2/20 0.72
▸ CHEK2 O96017 2/20 0.72
▸ PDPK1 O15530 2/20 0.72
▸ PLK4 O00444 1/20 0.72

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
SCHEMBL8185332 0.90 TLK2 (0.68) TLK2CDK5KDRPDGFRBCDK1
SCHEMBL7832595 0.84 TLK2 (0.67) TLK2CDK5KDRPDGFRBCDK1
Su-9516 SCHEMBL1170686 0.84 TLK2 (1.00) TLK2CDK5KDRPDGFRBCDK1
Su-9516 SCHEMBL1170687 0.84 TLK2 (1.00) TLK2CDK5KDRPDGFRBCDK1
Su-9516 SCHEMBL29705821 0.84 TLK2 (1.00) TLK2CDK5KDRPDGFRBCDK1
SCHEMBL8192156 0.81 KDR (0.59) TLK2CDK5KDRPDGFRBCDK1
SCHEMBL12722125 0.80 TLK2 (0.67) TLK2CDK5KDRPDGFRBCDK1
SCHEMBL20402601 0.77 TLK2 (0.63) TLK2CDK5KDRPDGFRBCDK1
SCHEMBL20402600 0.77 CSF1R (0.72) TLK2CDK5KDRPDGFRBCDK1
SCHEMBL11926760 0.77 TLK2 (0.63) TLK2CDK5KDRPDGFRBCDK1

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 3 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-A9 HETEROCYCLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE SUGEN INC (US) 2000-04-20 — — WO disclosed
WO-1999048868-A2 HETEROCYCLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE SUGEN, INC. (US) 1999-09-30 — — WO disclosed
Send feedback