SCHEMBL31453702

SCHEMBL31453702

CCOC(=O)/C=C\C(=O)N(c1ccc(F)c(Cl)c1)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
MAPT P10636 5/20 0.41
MDM2 Q00987 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
CYP3A4 P08684 1/20 0.38
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.37
POLQ O75417 1/20 0.37
TSHR P16473 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NR1H4 Q96RI1 1/20 0.35

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
SCHEMBL31453640 1.00 ALDH1A1 (0.43) ALDH1A1MAPTMDM2L3MBTL1CYP3A4
SCHEMBL31453555 0.91 MAPT (0.42) ALDH1A1MAPTMDM2L3MBTL1CYP3A4
SCHEMBL31453677 0.84 ALDH1A1 (0.45) ALDH1A1MAPTL3MBTL1CYP3A4LMNA
SCHEMBL31453537 0.83 MAPT (0.43) ALDH1A1MAPTL3MBTL1CYP3A4LMNA
SCHEMBL31453592 0.80 ALDH1A1 (0.40) ALDH1A1MAPTL3MBTL1LMNAPOLQ
SCHEMBL27583241 0.76 ALDH1A1 (0.51) ALDH1A1MAPTLMNAKMT2APOLQ
SCHEMBL31453570 0.75 MAPT (0.41) ALDH1A1MAPTMDM2L3MBTL1CYP3A4
SCHEMBL635894 0.73 RORC (0.43) ALDH1A1MAPTMDM2L3MBTL1LMNA
SCHEMBL635895 0.73 RORC (0.43) ALDH1A1MAPTMDM2L3MBTL1LMNA
SCHEMBL31453654 0.73 CYP3A4 (0.40) ALDH1A1MAPTMDM2L3MBTL1CYP3A4

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-2025016138-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF SUZHOU EOC MEDICAL RESEARCH CO., LTD. (CN) 2025-01-23 WO disclosed