SCHEMBL30516108

SCHEMBL30516108

FC(F)(F)Oc1cccc(CBr)c1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CETP P11597 8/20 0.59
CHRM2 P08172 1/20 0.50
CHRM1 P11229 1/20 0.50
CHRM3 P20309 1/20 0.50
DAO P14920 1/20 0.49
MAPK14 Q16539 1/20 0.46
TRPM8 Q7Z2W7 1/20 0.44
SLC6A4 P31645 1/20 0.43
CARM1 Q86X55 1/20 0.43
PRMT6 Q96LA8 1/20 0.43

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
SCHEMBL77358 1.00 CETP (0.59) CETPCHRM2CHRM1CHRM3DAO
SCHEMBL4164702 0.93 CETP (0.56) CETPCHRM2CHRM1CHRM3DAO
SCHEMBL30677435 0.85 CHRM2 (0.55) CETPCHRM2CHRM1CHRM3DAO
SCHEMBL3119286 0.85 CHRM2 (0.55) CETPCHRM2CHRM1CHRM3DAO
SCHEMBL5009648 0.84 DAO (0.55) CETPCHRM2CHRM1CHRM3DAO
SCHEMBL3284271 0.84 CETP (0.51) CETP
SCHEMBL178310 0.82 CHRM2 (0.55) CETPCHRM2CHRM1CHRM3DAO
SCHEMBL19062249 0.82 CETP (0.53) CETPCHRM2CHRM1CHRM3DAO
SCHEMBL80141 0.82 CHRM2 (0.52) CETPCHRM2CHRM1CHRM3DAO
SCHEMBL2094315 0.81 CETP (0.51) CETPCHRM2CHRM1CHRM3DAO

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
CN-119019374-A Carbazole compound for preventing and treating plant pathogenic bacteria, and synthetic method and application thereof 贵州大学 2024-11-26 CN disclosed
CN-116514790-A Tri-aromatic heterocyclic piperazine small molecular organic compound targeting STAT3 and application thereof 华东师范大学 2023-08-01 CN disclosed