SCHEMBL8452274

SCHEMBL8452274

Cc1ccc([C@H]2CC[C@H](CCc3cc(F)c(-c4ccc(Cl)cc4)c(F)c3)CC2)cc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.35
SLC2A1 P11166 1/20 0.35
OPRL1 P41146 4/20 0.34
DRD2 P14416 3/20 0.34
PTGS2 P35354 1/20 0.34
DGAT1 O75907 1/20 0.34
SOAT1 P35610 1/20 0.34
DRD4 P21917 2/20 0.33
DRD3 P35462 2/20 0.33
LSS P48449 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
ALPG P10696 1/20 0.33
ALOX12 P18054 1/20 0.33
KMT2A Q03164 1/20 0.33
MAOB P27338 2/20 0.33

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
SCHEMBL8452277 1.00 CNR1 (0.35) CNR1SLC2A1OPRL1DRD2PTGS2
SCHEMBL8451165 0.90 MAOB (0.40) CNR1PTGS2MEN1KMT2AMAOB
SCHEMBL8451161 0.90 MAOB (0.40) CNR1PTGS2MEN1KMT2AMAOB
SCHEMBL8452400 0.90 ALDH1A1 (0.38) CNR1OPRL1DRD2DGAT1SOAT1
SCHEMBL8452406 0.90 ALDH1A1 (0.38) CNR1OPRL1DRD2DGAT1SOAT1
SCHEMBL8452531 0.89 ESR2 (0.33) SLC2A1OPRL1DGAT1SOAT1MEN1
SCHEMBL8452526 0.89 ESR2 (0.33) SLC2A1OPRL1DGAT1SOAT1MEN1
SCHEMBL8452573 0.89 DRD2 (0.38) CNR1OPRL1DRD2DGAT1SOAT1
SCHEMBL8451004 0.89 SLC6A2 (0.35) OPRL1DGAT1MAOB
SCHEMBL8451001 0.89 SLC6A2 (0.35) OPRL1DGAT1MAOB

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