SCHEMBL8010347

SCHEMBL8010347

O=P(Cc1cccc2cccc(-c3cccc4cccc(CP(=O)(c5ccccc5)c5ccccc5)c34)c12)(c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
CYP3A4 P08684 2/20 0.44
CYP2C19 P33261 1/20 0.44
ALDH1A1 P00352 7/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 3/20 0.42
TSHR P16473 2/20 0.42
MAPK1 P28482 2/20 0.42
ATM Q13315 1/20 0.42
GAA P10253 3/20 0.40
NPSR1 Q6W5P4 3/20 0.40
MAPT P10636 1/20 0.40
ALPG P10696 1/20 0.40
ALOX12 P18054 1/20 0.40
NPY1R P25929 1/20 0.40
NPY2R P49146 1/20 0.40
CASP1 P29466 2/20 0.39
CASP7 P55210 2/20 0.39
PABPC1 P11940 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
SCHEMBL752826 0.79 HTT (0.66) HTTL3MBTL1CYP3A4CYP2C19ALDH1A1
SCHEMBL25936841 0.79 ACP3 (0.62) HTTL3MBTL1CYP3A4CYP2C19ALDH1A1
Naphthalene SCHEMBL28276940 0.74 CYP3A4 (0.61) HTTL3MBTL1CYP3A4CYP2C19ALDH1A1
SCHEMBL8679316 0.73 CYP3A4 (0.42) HTTL3MBTL1CYP3A4CYP2C19ALDH1A1
SCHEMBL8020123 0.72 HTT (0.54) HTTL3MBTL1CYP3A4CYP2C19ALDH1A1
SCHEMBL755028 0.71 CYP3A4 (0.68) HTTL3MBTL1CYP3A4CYP2C19ALDH1A1
SCHEMBL518265 0.71 CYP3A4 (0.68) HTTL3MBTL1CYP3A4CYP2C19ALDH1A1
SCHEMBL10431512 0.71 HTT (0.61) HTTL3MBTL1CYP3A4CYP2C19ALDH1A1
SCHEMBL29119914 0.71 HTT (0.56) HTTL3MBTL1CYP3A4CYP2C19ALDH1A1
SCHEMBL10824828 0.71 HTT (0.65) HTTL3MBTL1CYP3A4CYP2C19ALDH1A1

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-0653432-B1 Process for preparing bis-(diaryl-alkyl)-phosphines and derivatives of this class of substances CELANESE CHEM EUROPE GMBH (DE) 2000-02-09 EP disclosed
US-5600006-A Bis(diarylalkyl)phosphines HOECHST A.G. (DE) 1997-02-04 US disclosed
EP-0653432-A1 Process for preparing bis-(diaryl-alkyl)-phosphines and novel derivatives of this class of substances HOECHST AKTIENGESELLSCHAFT (DE) 1995-05-17 EP disclosed