SCHEMBL31049396

SCHEMBL31049396

C[C@H]1CO[C@@H](CO)CN1c1cc(S(=O)(=O)NC2(C#N)CC2)cn2c(-c3nnc(C(F)F)s3)ncc12

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PARG Q86W56 20/20 0.41

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
SCHEMBL31049550 0.93 PARG (0.39) PARG
SCHEMBL31049411 0.93 PARG (0.44) PARG
SCHEMBL31049294 0.90 PARG (0.39) PARG
SCHEMBL31049462 0.90 PARG (0.39) PARG
SCHEMBL31049663 0.90 PARG (0.39) PARG
SCHEMBL31049399 0.90 PARG (0.39) PARG
SCHEMBL31049586 0.89 PARG (0.40) PARG
SCHEMBL31049477 0.89 PARG (0.40) PARG
SCHEMBL31049640 0.89 PARG (0.35) PARG
SCHEMBL31049344 0.87 PARG (0.39) PARG

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
WO-2024173453-A1 HETEROARYL-SUBSTITUTED IMIDAZOPYRIDINE COMPOUNDS IDEAYA BIOSCIENCES, INC. (US) 2024-08-22 WO disclosed