SCHEMBL31049550

SCHEMBL31049550

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

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PARG Q86W56 20/20 0.39

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
SCHEMBL31049396 0.93 PARG (0.41) PARG
SCHEMBL31049357 0.91 PARG (0.38) PARG
SCHEMBL31049553 0.91 PARG (0.38) PARG
SCHEMBL31049508 0.89 PARG (0.38) PARG
SCHEMBL31049554 0.89 PARG (0.38) PARG
SCHEMBL31049418 0.89 PARG (0.33) PARG
SCHEMBL31049423 0.89 PARG (0.33) PARG
SCHEMBL31049420 0.88 PARG (0.39) PARG
SCHEMBL31049411 0.86 PARG (0.44) PARG
SCHEMBL31049294 0.83 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