SCHEMBL8719683

SCHEMBL8719683

CCCCCCCCCCOc1ccc(-c2ccc(CCC(C)OCCCC)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.52
CYP3A4 P08684 2/20 0.47
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.47
CASP1 P29466 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SLCO1B3 Q9NPD5 1/20 0.47
SLCO1B1 Q9Y6L6 1/20 0.47
NR5A1 Q13285 1/20 0.46
TP53 P04637 2/20 0.46
TSHR P16473 1/20 0.46
CYP2D6 P10635 1/20 0.45
PLA2G4B P0C869 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
S1PR4 O95977 1/20 0.43

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
SCHEMBL9097993 0.92 MEN1 (0.51) RARBCYP3A4MEN1USP2ALDH1A1
SCHEMBL7856791 0.87 RAB9A (0.52) RARBCYP3A4MEN1USP2ALDH1A1
SCHEMBL9512657 0.85 MEN1 (0.49) RARBCYP3A4MEN1USP2ALDH1A1
SCHEMBL9513801 0.85 MEN1 (0.49) RARBCYP3A4MEN1USP2ALDH1A1
SCHEMBL9512035 0.85 MEN1 (0.49) RARBCYP3A4MEN1USP2ALDH1A1
SCHEMBL9512636 0.85 MEN1 (0.49) RARBCYP3A4MEN1USP2ALDH1A1
SCHEMBL8716741 0.84 HRH3 (0.55) RARBCYP3A4MEN1USP2ALDH1A1
SCHEMBL10748461 0.84 RARB (0.50) RARBCYP3A4MEN1USP2ALDH1A1
SCHEMBL10709063 0.84 RARB (0.50) RARBCYP3A4MEN1USP2ALDH1A1
SCHEMBL10748452 0.84 RARB (0.50) RARBCYP3A4MEN1USP2ALDH1A1

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-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