SCHEMBL22731982

SCHEMBL22731982

C[Si](C)(C)CCOCn1ncc2c(C(O)CO)ccc(Cl)c21

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ F2RL1 P55085 1/20 0.36
▸ SCN9A Q15858 2/20 0.33

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
SCHEMBL29574946 1.00 F2RL1 (0.36) F2RL1SCN9A
SCHEMBL24631037 0.87 F2RL1 (0.43) F2RL1SCN9A
SCHEMBL28724403 0.87 F2RL1 (0.43) F2RL1SCN9A
SCHEMBL29594153 0.87 F2RL1 (0.43) F2RL1SCN9A
SCHEMBL29574531 0.81 F2RL1 (0.32) F2RL1
SCHEMBL22732165 0.81 F2RL1 (0.32) F2RL1
SCHEMBL22731956 0.80 DGAT1 (0.32) —
SCHEMBL30311811 0.79 DGAT1 (0.34) —
SCHEMBL22717311 0.79 DGAT1 (0.34) —
SCHEMBL22717739 0.78 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3976608-B1 THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES INC (US) 2023-11-08 — — EP disclosed
CN-114127062-A Thiadiazolyl derivatives as inhibitors of DNA polymerase Theta 伊迪亚生物科学有限公司 2022-03-01 — — CN disclosed
WO-2020243459-A1 THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2020-12-03 — — WO disclosed
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