SCHEMBL8638145

SCHEMBL8638145

CCCCC1C=CC(c2ccc(F)cc2)=CC1

nearest known ligand 0.31

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MMP2 P08253 1/20 0.31
MC4R P32245 1/20 0.31
RAD52 P43351 1/20 0.31
HTR7 P34969 1/20 0.31
GCGR P47871 2/20 0.31
GRM2 Q14416 1/20 0.31
CHRM1 P11229 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
TLR8 Q9NR97 1/20 0.30
PAX8 Q06710 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
SCHEMBL8636477 0.96 GRM2 (0.35) PSMD14HSP90AA1MMP2MC4RRAD52
SCHEMBL8640995 0.94 GRM2 (0.37) PSMD14HSP90AA1MMP2MC4RRAD52
SCHEMBL8637984 0.94 GRM2 (0.37) PSMD14HSP90AA1MMP2MC4RRAD52
SCHEMBL8640877 0.94 GRM2 (0.37) PSMD14HSP90AA1MMP2MC4RRAD52
SCHEMBL8636705 0.94 GRM2 (0.37) PSMD14HSP90AA1MMP2MC4RRAD52
SCHEMBL8637039 0.94 GRM2 (0.37) PSMD14HSP90AA1MMP2MC4RRAD52
SCHEMBL8636717 0.91 ALDH1A1 (0.30)
SCHEMBL8638434 0.85 NPC1 (0.33)
SCHEMBL8635282 0.85 GCGR (0.34) GCGR
SCHEMBL8637216 0.85 TLR8 (0.34) TLR8

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0571652-B1 Liquid crystalline substituted dihydrobenzene derivatives CITIZEN WATCH CO LTD (JP) 1998-08-05 EP disclosed
US-5342546-A Liquid crystal compositions L.C.C. CONSULTANTS CO., LTD. (JP) 1994-08-30 US disclosed
EP-0571652-A1 Liquid crystalline substituted dihydrobenzene derivatives L.C.C. CONSULTANTS CO., LTD. (JP) 1993-12-01 EP disclosed