SCHEMBL8448343

SCHEMBL8448343

CCCCc1ccc(CC[C@H]2CC[C@H](CCc3cc(F)c(-c4ccc(Cl)cc4)c(F)c3)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 1/20 0.41
MAOB P27338 1/20 0.39
GCGR P47871 1/20 0.38
SLC6A3 Q01959 1/20 0.38
GPR84 Q9NQS5 1/20 0.38
KCNH2 Q12809 4/20 0.36
CNR2 P34972 1/20 0.36
NISCH Q9Y2I1 1/20 0.36
RARB P10826 2/20 0.36
RARA P10276 1/20 0.36
RARG P13631 1/20 0.36
FAAH O00519 2/20 0.35
MGLL Q99685 1/20 0.35
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35
APH1A Q96BI3 1/20 0.35
PSENEN Q9NZ42 1/20 0.35

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
SCHEMBL8448346 1.00 CTRC (0.41) CTRCMAOBGCGRSLC6A3GPR84
SCHEMBL8453552 0.96 KCNH2 (0.41) CTRCMAOBGCGRSLC6A3GPR84
SCHEMBL8453555 0.96 KCNH2 (0.41) CTRCMAOBGCGRSLC6A3GPR84
SCHEMBL8453796 0.95 KCNH2 (0.43) CTRCMAOBGPR84KCNH2RARB
SCHEMBL8452270 0.95 KCNH2 (0.43) CTRCMAOBGPR84KCNH2RARB
SCHEMBL8452266 0.95 KCNH2 (0.43) CTRCMAOBGPR84KCNH2RARB
SCHEMBL8453799 0.95 KCNH2 (0.43) CTRCMAOBGPR84KCNH2RARB
SCHEMBL8456001 0.93 SPHK1 (0.42) CTRCSLC6A3
SCHEMBL8456005 0.93 SPHK1 (0.42) CTRCSLC6A3
SCHEMBL8453201 0.93 MAOB (0.40) MAOBGPR84CNR2NISCHFAAH

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