SCHEMBL23891735

SCHEMBL23891735

Cc1cc(F)c2c(c1)CCC2=O

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.36
NOTUM Q6P988 1/20 0.35
HSD17B1 P14061 1/20 0.33
SRD5A1 P18405 1/20 0.32
PARP10 Q53GL7 1/20 0.30
PARP11 Q9NR21 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
SCHEMBL1274254 0.79 BRD4 (0.38) BRD4SRD5A1
SCHEMBL321647 0.79 DRD2 (0.36) HSD17B1SRD5A1
SCHEMBL16290456 0.78 HSD17B1 (0.34) HSD17B1SRD5A1
SCHEMBL13892590 0.76 ALDH1A1 (0.37) BRD4SRD5A1PARP10PARP11
SCHEMBL9016026 0.76 CASP1 (0.37) BRD4SRD5A1PARP10PARP11
SCHEMBL30994051 0.76 ACLY (0.45) HSD17B1
SCHEMBL5955592 0.76 NOTUM (0.38) BRD4NOTUMSRD5A1PARP10PARP11
SCHEMBL1727000 0.76 HSD17B1 (0.33) HSD17B1SRD5A1PARP10PARP11
SCHEMBL21098684 0.76 PBRM1 (0.41) HSD17B1
SCHEMBL29375857 0.76 HSD17B1 (0.33) HSD17B1SRD5A1PARP10PARP11

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
EP-3889138-A1 HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF Hinova Pharmaceuticals Inc. (CN) 2021-10-06 EP disclosed