SCHEMBL5677666

SCHEMBL5677666

NC(=O)c1ccc2nc(-c3ccc(S(=O)(=O)NCc4ccc(Cl)cc4)cc3)[nH]c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 20/20 1.00

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
SCHEMBL1380253 0.92 CHEK2 (0.86) CHEK2
SCHEMBL1381568 0.83 CHEK2 (0.86) CHEK2
SCHEMBL3559494 0.83 CHEK2 (0.86) CHEK2
SCHEMBL1379810 0.82 CHEK2 (0.85) CHEK2
SCHEMBL1378643 0.82 CHEK2 (0.85) CHEK2
SCHEMBL3560900 0.81 CHEK2 (0.68) CHEK2
SCHEMBL5178080 0.80 CHEK2 (0.67) CHEK2
SCHEMBL3571821 0.80 CHEK2 (0.86) CHEK2
SCHEMBL3917246 0.80 CHEK2 (0.76) CHEK2
SCHEMBL5680477 0.80 CHEK2 (1.00) CHEK2

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-1613313-A1 2-PHENYL-BENZIMIDAZOL AND 2-PHENYL-IMIDAZO-4,5!-PYRIDINE DERIVATIVES AS CHECKPOINT KINASE CDS1 (CHK2) INHIBITORS FOR THE TREATMENT OF CANCER JANSSEN PHARMACEUTICA N.V. (BE) 2006-01-11 EP disclosed
WO-2004093873-A1 2-PHENYL-BENZIMIDAZOL AND 2-PHENYL-IMIDAZO-`4,5!-PYRIDINE DERIVATIVES AS CHECKPOINT KINASE CDS1 (CHK2) INHIBITORS FOR THE TREATMENT OF CANCER JANSSEN PHARMACEUTICA, N.V. (BE) 2004-11-04 WO disclosed