SCHEMBL8765734

SCHEMBL8765734

Nc1ccc(Cc2ccc(Cc3ccc(Cc4ccc(N)c(Cl)c4)cc3)cc2)cc1Cl

nearest known ligand 0.95

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.95
TSHR P16473 6/20 0.52
GAA P10253 4/20 0.52
POLB P06746 2/20 0.52
KDM4E B2RXH2 2/20 0.52
MAPT P10636 2/20 0.52
MEN1 O00255 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 7/20 0.50
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 1/20 0.46
CDC25B P30305 1/20 0.45
CASP6 P55212 1/20 0.45
RCE1 Q9Y256 1/20 0.45
HPGD P15428 2/20 0.42
ALOX15 P16050 2/20 0.42
HSD17B10 Q99714 2/20 0.42
ESR2 Q92731 1/20 0.42
THRB P10828 1/20 0.42

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
SCHEMBL43509 0.98 CYP3A4 (1.00) CYP3A4TSHRGAAPOLBKDM4E
SCHEMBL30097830 0.98 CYP3A4 (1.00) CYP3A4TSHRGAAPOLBKDM4E
Ammonia Solution, Strong SCHEMBL9140534 0.95 CYP3A4 (0.95) CYP3A4TSHRGAAPOLBKDM4E
SCHEMBL5271470 0.94 CYP3A4 (0.83) CYP3A4TSHRGAAPOLBKDM4E
SCHEMBL6351215 0.92 CYP3A4 (0.80) CYP3A4TSHRGAAPOLBKDM4E
SCHEMBL11058899 0.91 CYP3A4 (0.87) CYP3A4TSHRGAAPOLBKDM4E
SCHEMBL11482589 0.89 CYP3A4 (0.83) CYP3A4TSHRGAAPOLBKDM4E
SCHEMBL10714891 0.89 CYP3A4 (0.83) CYP3A4TSHRGAAPOLBKDM4E
SCHEMBL11229105 0.86 CYP3A4 (0.77) CYP3A4TSHRGAAPOLBKDM4E
SCHEMBL12607303 0.86 CYP3A4 (0.77) CYP3A4TSHRGAAPOLBKDM4E

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