SCHEMBL8765756

SCHEMBL8765756

Nc1ccc(Cc2ccc(Cc3ccc(Cc4ccc(N)cc4)c(Cl)c3)cc2Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.56
ALDH1A1 P00352 1/20 0.56
TSHR P16473 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
CYP17A1 P05093 1/20 0.41
CYP19A1 P11511 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
SLC6A2 P23975 3/20 0.41
SLC6A4 P31645 3/20 0.41
SLC6A3 Q01959 3/20 0.41
PNMT P11086 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
GFER P55789 1/20 0.39
HTR6 P50406 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL990234 0.90 CYP3A4 (0.52) CYP3A4ALDH1A1TSHRTDP1CYP17A1
SCHEMBL31175762 0.90 CYP3A4 (0.52) CYP3A4ALDH1A1TSHRTDP1CYP17A1
SCHEMBL21186285 0.83 CYP3A4 (0.45) CYP3A4ALDH1A1TSHRTDP1HSD17B10
SCHEMBL1149063 0.82 MAPT (0.49) CYP3A4ALDH1A1TSHRTDP1TAAR1
SCHEMBL5271470 0.82 CYP3A4 (0.83) CYP3A4ALDH1A1TSHRTDP1CYP17A1
SCHEMBL9629297 0.82 CYP3A4 (0.52) CYP3A4ALDH1A1TSHRTDP1CYP17A1
SCHEMBL23066054 0.79 CYP3A4 (0.61) CYP3A4ALDH1A1TSHRTDP1CYP17A1
SCHEMBL11058899 0.79 CYP3A4 (0.87) CYP3A4ALDH1A1TSHRTDP1CYP17A1
SCHEMBL14268291 0.78 ALOX15 (0.46) CYP3A4ALDH1A1TSHRTDP1HSD17B10
SCHEMBL21186239 0.78 ALDH1A1 (0.52) CYP3A4ALDH1A1TSHRTDP1PNMT

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
EP-0575083-B1 Liquid crystal aligning films and liquid crystal display devices CHISSO CORP (JP) 1997-08-13 EP disclosed
US-5432256-A Liquid crystal aligning films and liquid crystal display devices CHISSO CORPORATION (JP) 1995-07-11 US disclosed
EP-0575083-A1 Liquid crystal aligning films and liquid crystal display devices CHISSO CORPORATION (JP) 1993-12-22 EP disclosed