SCHEMBL8452242

SCHEMBL8452242

CCCCCCc1ccc(CC[C@H]2CC[C@H](CCc3cc(F)c(-c4ccc(Cl)c(F)c4)c(F)c3)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RARB P10826 8/20 0.43
RARA P10276 2/20 0.43
RARG P13631 1/20 0.43
HTR2A P28223 1/20 0.37
HSD11B1 P28845 1/20 0.36
SPHK1 Q9NYA1 5/20 0.36
HRH3 Q9Y5N1 1/20 0.36
ITGB3 P05106 1/20 0.35
ITGA2B P08514 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GPR84 Q9NQS5 1/20 0.35
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
MTOR P42345 1/20 0.34
KMT2A Q03164 1/20 0.34
SPHK2 Q9NRA0 1/20 0.34

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
SCHEMBL8452245 1.00 RARB (0.43) RARBRARARARGHTR2AHSD11B1
SCHEMBL8452049 1.00 RARB (0.43) RARBRARARARGHTR2AHSD11B1
SCHEMBL8452045 1.00 RARB (0.43) RARBRARARARGHTR2AHSD11B1
SCHEMBL8451776 0.99 RARB (0.41) RARBRARARARGHTR2AHSD11B1
SCHEMBL8451782 0.99 RARB (0.41) RARBRARARARGHTR2AHSD11B1
SCHEMBL8447708 0.95 RARB (0.37) RARBRARARARGHSD11B1HRH3
SCHEMBL8447705 0.95 RARB (0.37) RARBRARARARGHSD11B1HRH3
SCHEMBL8450972 0.94 SPHK1 (0.46) RARBRARARARGSPHK1SPHK2
SCHEMBL8450977 0.94 SPHK1 (0.46) RARBRARARARGSPHK1SPHK2
SCHEMBL8453708 0.93 SPHK1 (0.45) RARBRARARARGHSD11B1SPHK1

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