SCHEMBL24501199

SCHEMBL24501199

COc1cccc(F)c1-c1cnncc1C(=O)Nc1nnc(OCc2ccc(Cl)cn2)s1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ POLQ O75417 19/20 0.56
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43

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
SCHEMBL29694688 1.00 POLQ (0.56) POLQKDM4EALDH1A1HPGDHSD17B10
SCHEMBL22717495 0.90 POLQ (0.71) POLQ
SCHEMBL29574407 0.90 POLQ (0.60) POLQ
SCHEMBL29575166 0.90 POLQ (0.71) POLQ
SCHEMBL22717500 0.90 POLQ (0.60) POLQ
SCHEMBL29108403 0.88 POLQ (0.58) POLQ
SCHEMBL22718445 0.88 POLQ (0.67) POLQKDM4EALDH1A1HPGDHSD17B10
SCHEMBL29574647 0.88 POLQ (0.67) POLQKDM4EALDH1A1HPGDHSD17B10
SCHEMBL22717436 0.87 POLQ (0.57) POLQ
SCHEMBL29574367 0.87 POLQ (0.57) POLQ

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
CN-117083271-A Substituted thiadiazolyl derivatives as DNA polymerase theta inhibitors 伊迪亚生物科学有限公司 2023-11-17 — — CN disclosed
WO-2022118210-A1 SUBSTITUTED THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2022-06-09 — — WO disclosed
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