SCHEMBL8095372

SCHEMBL8095372

CCCCCc1ccc(-c2c(-c3ccccc3)cc(F)c(F)c2F)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.48
GPR3 P46089 1/20 0.42
PSMB5 P28074 1/20 0.41
HSD11B1 P28845 1/20 0.40
RARA P10276 1/20 0.40
RARG P13631 1/20 0.40
GCGR P47871 2/20 0.37
FAAH O00519 1/20 0.36
PTGS2 P35354 1/20 0.36
HTR2A P28223 1/20 0.36

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
SCHEMBL8110566 0.91 PDK2 (0.37) RARBPSMB5PTGS2
SCHEMBL9764072 0.87 RARB (0.50) RARBPSMB5HSD11B1RARARARG
SCHEMBL9561635 0.86 RARB (0.60) RARBGPR3PSMB5HSD11B1RARA
SCHEMBL9763649 0.86 RARB (0.52) RARBGPR3HSD11B1RARARARG
SCHEMBL9763632 0.86 RARB (0.52) RARBGPR3HSD11B1RARARARG
SCHEMBL9764331 0.86 RARB (0.52) RARBGPR3HSD11B1RARARARG
SCHEMBL9763731 0.86 RARB (0.52) RARBGPR3HSD11B1RARARARG
SCHEMBL9764026 0.86 RARB (0.52) RARBGPR3HSD11B1RARARARG
SCHEMBL9505504 0.83 HSD11B1 (0.47) RARBPSMB5HSD11B1RARARARG
SCHEMBL26193728 0.82 RARB (0.55) RARBGPR3PSMB5HSD11B1RARA

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5487845-A ELECTROOPTICAL DISPLAY ELEMENTS; CHEMICAL, HEAT AND LIGHT STABILITY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1996-01-30 US claimed
EP-0628532-B1 Fluorobenzole derivatives and mesomorphous medium MERCK PATENT GMBH (DE) 2000-01-19 EP disclosed
US-5641429-A STABLE COMPOUNDS HAVING LOW VISCOSITY AND HIGH DIELECTRIC ANISOTROPY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1997-06-24 US disclosed
US-5536442-A ELECTROOPTICS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1996-07-16 US disclosed
US-5487845-A ELECTROOPTICAL DISPLAY ELEMENTS; CHEMICAL, HEAT AND LIGHT STABILITY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1996-01-30 US disclosed
EP-0441932-B1 FLUOROBENZOLE DERIVATIVES AND MESOMORPHOUS MEDIUM MERCK PATENT GMBH (DE) 1995-03-15 EP disclosed
EP-0628532-A1 Fluorobenzole derivatives and mesomorphous medium MERCK PATENT GmbH (DE) 1994-12-14 EP disclosed
WO-1991003450-A1 FLUOROBENZOLE DERIVATIVES AND MESOMORPHOUS MEDIUM MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1991-03-21 WO disclosed