SCHEMBL5828251

SCHEMBL5828251

CNc1ccc2c(c1)c1c3c(c(-c4ccccc4Cl)cc1n2C)C(=O)NC3=O

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
WEE1 P30291 20/20 0.74
CHEK1 O14757 16/20 0.74
CDK1 P06493 3/20 0.57
CCNB1 P14635 2/20 0.57

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
SCHEMBL5828848 0.90 WEE1 (0.71) WEE1CHEK1CDK1CCNB1
SCHEMBL5829850 0.89 WEE1 (0.70) WEE1CHEK1CDK1CCNB1
SCHEMBL5829407 0.88 WEE1 (0.71) WEE1CHEK1CDK1CCNB1
SCHEMBL6230406 0.87 WEE1 (0.70) WEE1CHEK1CDK1CCNB1
SCHEMBL5828662 0.86 WEE1 (0.64) WEE1CHEK1CDK1CCNB1
SCHEMBL5829211 0.85 WEE1 (0.56) WEE1CHEK1CDK1CCNB1
SCHEMBL9835028 0.85 WEE1 (0.77) WEE1CHEK1CDK1
SCHEMBL5828569 0.85 WEE1 (0.77) WEE1CHEK1CDK1CCNB1
SCHEMBL5829356 0.85 WEE1 (0.77) WEE1CHEK1CDK1CCNB1
SCHEMBL5828081 0.85 CHEK1 (1.00) WEE1CHEK1CDK1CCNB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7094798-B1 Inhibitors of checkpoint kinases (Wee1 and Chk1) PFIZER INC (US) 2006-08-22 US disclosed