SCHEMBL31328629

SCHEMBL31328629

COCOc1cc(C(N)=O)c2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c(F)ccc2c1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.32
SYK P43405 1/20 0.31
FYN P06241 1/20 0.31
PARP10 Q53GL7 2/20 0.30
PARP15 Q460N3 1/20 0.30
PARP14 Q460N5 1/20 0.30

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
SCHEMBL31328669 0.91 CAMKK1 (0.32) GRM5
SCHEMBL31380685 0.90 GRM5 (0.33) GRM5
SCHEMBL23043188 0.85 GRM5 (0.30) GRM5
SCHEMBL31328721 0.85
SCHEMBL29418866 0.85 GRM5 (0.30) GRM5
SCHEMBL31732832 0.85 KDM4E (0.33)
SCHEMBL31328518 0.84
SCHEMBL30707569 0.83
SCHEMBL27302945 0.83 GRM5 (0.32) GRM5
SCHEMBL31732909 0.83

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-2025040767-A1 2-(3,8-DIAZABICYCLO[3.2.1]OCTAN-3-YL)-1,3,5-TRIAZINE DERIVATIVES AS KRAS G12D INHIBITORS FOR THE TREATMENT OF CANCER SANOFI (FR) 2025-02-27 WO disclosed