SCHEMBL8447274

SCHEMBL8447274

CCc1ccc([C@H]2CC[C@H](CCc3cc(F)c(CCc4ccc(Cl)c(F)c4)c(F)c3)CC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PROKR1 Q8TCW9 3/20 0.33
CYP2C9 P11712 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
ESR2 Q92731 1/20 0.32
OPRL1 P41146 4/20 0.31
FPR2 P25090 2/20 0.31
SPHK1 Q9NYA1 2/20 0.31
CNR1 P21554 2/20 0.30
CCR3 P51677 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
SCHEMBL8447275 1.00 PROKR1 (0.33) PROKR1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL8451081 0.93 SPHK1 (0.36) PROKR1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL8451079 0.93 SPHK1 (0.36) PROKR1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL8448501 0.92 MAOA (0.36) PROKR1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL8448497 0.92 MAOA (0.36) PROKR1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL8447603 0.92 PROKR1 (0.33) PROKR1FPR2CCR3
SCHEMBL8447607 0.92 PROKR1 (0.33) PROKR1FPR2CCR3
SCHEMBL8451132 0.91 PROKR1 (0.35) PROKR1CYP2C9LMNAMAPTESR2
SCHEMBL8451127 0.91 PROKR1 (0.35) PROKR1CYP2C9LMNAMAPTESR2
SCHEMBL8452498 0.91 CYP2C9 (0.34) CYP2C9ALDH1A1LMNAMAPTMEN1

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