SCHEMBL31220060

SCHEMBL31220060

COC(=O)c1cc(Cl)ncc1C#CCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ATR Q13535 1/20 0.33
RET P07949 1/20 0.31
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
ALK Q9UM73 1/20 0.31
PGK1 P00558 1/20 0.31
GAA P10253 1/20 0.31
GRM5 P41594 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
SCHEMBL31219822 0.89 KDM4E (0.32) KDM4EATRLMNAMAPK1
SCHEMBL31219573 0.87 NNMT (0.31) RET
SCHEMBL28389771 0.80 GRM5 (0.36) KDM4ERETMAPK1ALKGAA
SCHEMBL29402440 0.80 GRM5 (0.36) KDM4ERETMAPK1ALKGAA
SCHEMBL15357877 0.79 CYP46A1 (0.40) KDM4ERETLMNAALKGAA
SCHEMBL23051557 0.78 GAA (0.42) KDM4ELMNAGAA
SCHEMBL29707038 0.78 GAA (0.42) KDM4ELMNAGAA
SCHEMBL31219562 0.76
SCHEMBL15360290 0.76 MAOB (0.42) KDM4EMAPK1
SCHEMBL31219830 0.76 KDM4E (0.41) KDM4EATRLMNAMAPK1GAA

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
EP-4713096-A1 CDK INHIBITOR COMPOUNDS Aleksia Therapeutics, Inc. (US) 2026-03-25 EP disclosed
WO-2024238574-A1 CDK INHIBITOR COMPOUNDS ALEKSIA THERAPEUTICS, INC. (US) 2024-11-21 WO disclosed