SCHEMBL8456014

SCHEMBL8456014

CCc1ccc(C2CCC(CCc3cc(F)c(-c4ccc(Cl)c(F)c4)c(F)c3)CC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PROKR1 Q8TCW9 2/20 0.35
FPR2 P25090 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP11B1 P15538 4/20 0.32
CYP11B2 P19099 4/20 0.32
DGAT1 O75907 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
MEN1 O00255 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
OPRL1 P41146 4/20 0.31
ESR2 Q92731 1/20 0.31
FFAR4 Q5NUL3 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
SCHEMBL8456006 1.00 PROKR1 (0.35) PROKR1FPR2GPR84CYP2C9CYP11B1
SCHEMBL8453692 0.93 MAOA (0.35) PROKR1FPR2GPR84CYP2C9ALDH1A1
SCHEMBL8453697 0.93 MAOA (0.35) PROKR1FPR2GPR84CYP2C9ALDH1A1
SCHEMBL8452201 0.92 GPR84 (0.38) PROKR1FPR2GPR84CYP11B1CYP11B2
SCHEMBL8452209 0.92 GPR84 (0.38) PROKR1FPR2GPR84CYP11B1CYP11B2
SCHEMBL8447369 0.91 SPHK1 (0.40) PROKR1
SCHEMBL8447365 0.91 SPHK1 (0.40) PROKR1
SCHEMBL8451004 0.90 SLC6A2 (0.35) PROKR1FPR2DGAT1OPRL1ESR2
SCHEMBL8451001 0.90 SLC6A2 (0.35) PROKR1FPR2DGAT1OPRL1ESR2
SCHEMBL8453574 0.90 SPHK1 (0.34) PROKR1GPR84CYP2C9CYP11B1CYP11B2

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