SCHEMBL8448282

SCHEMBL8448282

Cc1ccc([C@H]2CC[C@H](CCc3ccc(CCc4ccc(Cl)c(F)c4)c(F)c3)CC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
PROKR1 Q8TCW9 3/20 0.35
HTR2A P28223 4/20 0.35
HTR2C P28335 4/20 0.35
MAOB P27338 1/20 0.34
FPR2 P25090 2/20 0.33
CCR3 P51677 1/20 0.32
DRD4 P21917 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
ESR2 Q92731 1/20 0.32
OPRL1 P41146 3/20 0.31
AOC3 Q16853 1/20 0.31
CCR2 P41597 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
SCHEMBL8448287 1.00 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3PROKR1HTR2A
SCHEMBL8452803 0.93 MAOB (0.39) SLC6A2SLC6A4SLC6A3PROKR1MAOB
SCHEMBL8452805 0.93 MAOB (0.39) SLC6A2SLC6A4SLC6A3PROKR1MAOB
SCHEMBL8454671 0.92 MAOB (0.40) SLC6A2SLC6A4SLC6A3PROKR1HTR2A
SCHEMBL8454668 0.92 MAOB (0.40) SLC6A2SLC6A4SLC6A3PROKR1HTR2A
SCHEMBL8452359 0.91 HTR2A (0.35) PROKR1HTR2AHTR2CFPR2ESR2
SCHEMBL8452356 0.91 HTR2A (0.35) PROKR1HTR2AHTR2CFPR2ESR2
SCHEMBL8453846 0.91 MAOB (0.34) SLC6A2SLC6A4SLC6A3HTR2AHTR2C
SCHEMBL8447531 0.91 CNR1 (0.36) SLC6A2SLC6A4SLC6A3HTR2AHTR2C
SCHEMBL8453841 0.91 MAOB (0.34) SLC6A2SLC6A4SLC6A3HTR2AHTR2C

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