SCHEMBL8451001

SCHEMBL8451001

Cc1ccc([C@H]2CC[C@H](CCc3cc(F)c(-c4ccc(Cl)c(F)c4)c(F)c3)CC2)cc1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
PROKR1 Q8TCW9 3/20 0.35
ACACB O00763 2/20 0.33
ACACA Q13085 2/20 0.33
FPR2 P25090 2/20 0.33
CHRM4 P08173 1/20 0.32
DGAT1 O75907 2/20 0.32
MAOB P27338 1/20 0.32
ESR2 Q92731 1/20 0.32
OPRL1 P41146 5/20 0.31
FFAR4 Q5NUL3 1/20 0.31
CCR2 P41597 1/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31

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
SCHEMBL8451004 1.00 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3PROKR1ACACB
SCHEMBL8452651 0.91 MAOB (0.39) SLC6A2SLC6A4SLC6A3PROKR1ACACB
SCHEMBL8452649 0.91 MAOB (0.39) SLC6A2SLC6A4SLC6A3PROKR1ACACB
SCHEMBL8456006 0.90 PROKR1 (0.35) PROKR1FPR2DGAT1ESR2OPRL1
SCHEMBL8456014 0.90 PROKR1 (0.35) PROKR1FPR2DGAT1ESR2OPRL1
SCHEMBL8452526 0.90 ESR2 (0.33) CHRM4DGAT1MAOBESR2OPRL1
SCHEMBL8452531 0.90 ESR2 (0.33) CHRM4DGAT1MAOBESR2OPRL1
SCHEMBL8453692 0.89 MAOA (0.35) PROKR1FPR2MAOBFFAR4
SCHEMBL8453697 0.89 MAOA (0.35) PROKR1FPR2MAOBFFAR4
SCHEMBL8452274 0.89 CNR1 (0.35) DGAT1MAOBOPRL1

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
US-5858275-A Chlorobenzene derivative and liquid crystal composition containing the same CHISSO CORPORATION (JP) 1999-01-12 US disclosed
EP-0785179-A1 CHLOROBENZENE DERIVATIVE AND LIQUID-CRYSTAL COMPOSITION CONTAINING THE SAME CHISSO CORPORATION (JP) 1997-07-23 EP disclosed