SCHEMBL8716239

SCHEMBL8716239

CCCCCCCCCCOc1ccc(-c2ccc(CCC(C)OC(=O)CC)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.52
S1PR1 P21453 7/20 0.46
S1PR3 Q99500 6/20 0.46
S1PR5 Q9H228 5/20 0.46
S1PR4 O95977 2/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
PLA2G4B P0C869 2/20 0.45
PLA2G4A P47712 1/20 0.45

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
SCHEMBL9624886 0.93 RARB (0.50) RARBS1PR1S1PR3S1PR5S1PR4
SCHEMBL9094717 0.86 THRA (0.47) TP53TSHRPLA2G4B
SCHEMBL9625540 0.85 RARB (0.57) RARBTP53TSHRPLA2G4BPLA2G4A
SCHEMBL9624419 0.85 RARB (0.57) RARBTP53TSHRPLA2G4BPLA2G4A
SCHEMBL9624089 0.84 S1PR1 (0.50) RARBS1PR1S1PR3S1PR5S1PR4
SCHEMBL9624597 0.83 S1PR1 (0.48) RARBS1PR1S1PR3S1PR5S1PR4
SCHEMBL9097155 0.82 RARB (0.46) RARBTP53TSHRPLA2G4A
SCHEMBL9096285 0.82 RARB (0.51) RARBS1PR1PLA2G4A
SCHEMBL8719683 0.82 RARB (0.52) RARBS1PR1S1PR3S1PR5S1PR4
SCHEMBL9625810 0.81 RARB (0.56) RARBS1PR1S1PR3TP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5741438-A Optically active biphenyl derivative, process for preparation thereof, liquid crystal composition containing the same as an effective component, and liquid crystal element using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-04-21 US disclosed
EP-0395390-B1 Optically active biphenyl derivative, process for preparation thereof, liquid crystal composition containing the same as effective component, and liquid crystal element using the same SUMITOMO CHEMICAL CO (JP) 1994-09-28 EP disclosed
EP-0395390-A1 Optically active biphenyl derivative, process for preparation thereof, liquid crystal composition containing the same as effective component, and liquid crystal element using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-10-31 EP disclosed