SCHEMBL6977133

SCHEMBL6977133

COc1ccc(Nc2ccnc(Cl)n2)cc1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.57
IGF1R P08069 8/20 0.55
EGFR P00533 3/20 0.51
MAPK1 P28482 2/20 0.47
AURKA O14965 2/20 0.47
AURKB Q96GD4 2/20 0.47
PLK4 O00444 1/20 0.47
CHEK1 O14757 1/20 0.47
PDPK1 O15530 1/20 0.47
DAPK3 O43293 1/20 0.47
ROCK2 O75116 1/20 0.47
CHEK2 O96017 1/20 0.47
CDK1 P06493 1/20 0.47
CSF1R P07333 1/20 0.47
PIM1 P11309 1/20 0.47
FGFR1 P11362 1/20 0.47
FLT1 P17948 1/20 0.47
FGFR3 P22607 1/20 0.47
RPS6KB1 P23443 1/20 0.47
CDK2 P24941 1/20 0.47

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
SCHEMBL15741249 0.90 IGF1R (0.60) MAPTIGF1RBRD4MEN1NPC1
SCHEMBL30060569 0.90 IGF1R (0.60) MAPTIGF1RBRD4MEN1NPC1
SCHEMBL5659285 0.85 IGF1R (0.58) IGF1REGFRCDK2KDRMEN1
SCHEMBL1116446 0.84 IGF1R (0.73) MAPTIGF1REGFRMAPK1AURKA
SCHEMBL3988558 0.81 MAPT (0.74) MAPTEGFRPIM1FLT3ALOX5
SCHEMBL4818944 0.80 MAPT (0.69) MAPTIGF1REGFRMAPK1CDK2
SCHEMBL1131631 0.79 IGF1R (0.58) MAPTIGF1REGFRMAPK1AURKA
SCHEMBL6979267 0.79 IGF1R (0.54) MAPTIGF1REGFRMAPK1FGFR1
SCHEMBL6978657 0.78 EGFR (0.72) MAPTIGF1REGFRMAPK1KDR
SCHEMBL8348476 0.78 IGF1R (0.60) MAPTIGF1REGFRMAPK1AURKA

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
EP-0862560-B1 SUBSTITUTED 2-ANILINOPYRIMIDINES USEFUL AS PROTEIN KINASE INHIBITORS CELLTECH THERAPEUTICS LTD (GB) 2003-04-02 EP disclosed
US-6235746-B1 AUTOIMMUNE DISEASES; ANTIPROLIFERATIVE AGENT CELLTECH THERAPEUTICS, LIMITED (GB) 2001-05-22 US disclosed
US-5958935-A Substituted 2-anilinopyrimidines useful as protein kinase inhibitors CELLTECH THERAPEUTICS LIMITED (GB) 1999-09-28 US disclosed
EP-0862560-A1 SUBSTITUTED 2-ANILINOPYRIMIDINES USEFUL AS PROTEIN KINASE INHIBITORS CELLTECH THERAPEUTICS LIMITED (GB) 1998-09-09 EP disclosed
WO-1997019065-A1 SUBSTITUTED 2-ANILINOPYRIMIDINES USEFUL AS PROTEIN KINASE INHIBITORS CELLTECH THERAPEUTICS LIMITED (GB) 1997-05-29 WO disclosed