SCHEMBL7780989

SCHEMBL7780989

CN(C)c1ccc(P(=O)(Cc2ccc3ccccc3c2-c2c(CP(=O)(c3ccccc3)c3ccc(N(C)C)cc3)ccc3ccccc23)c2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 3/20 0.38
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 1/20 0.38
RAB9A P51151 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NOX1 Q9Y5S8 1/20 0.38
GPR84 Q9NQS5 1/20 0.38
RRM1 P23921 1/20 0.36
KDM1A O60341 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
HPGD P15428 1/20 0.35
CNR2 P34972 1/20 0.35
ALOX5 P09917 1/20 0.35

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
SCHEMBL7775603 0.87 HTT (0.46) HTTL3MBTL1MAPTALDH1A1MEN1
SCHEMBL8035798 0.82 HTT (0.43) HTTL3MBTL1MAPTALDH1A1GAA
SCHEMBL7777320 0.79 CES1 (0.42) HTTL3MBTL1MAPTALDH1A1MEN1
SCHEMBL8679316 0.78 CYP3A4 (0.42) HTTL3MBTL1MAPTALDH1A1MEN1
SCHEMBL5692296 0.75 HTT (0.41) HTTL3MBTL1MAPTALDH1A1MEN1
SCHEMBL8023388 0.74 CYP3A4 (0.41) HTTL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL7777329 0.73 ACP3 (0.39) HTTL3MBTL1ALDH1A1KDM4EMEN1
SCHEMBL8020866 0.73 ALDH1A1 (0.46) HTTL3MBTL1MAPTALDH1A1MEN1
SCHEMBL6544950 0.72 ACP3 (0.37) HTTL3MBTL1ALDH1A1TDP1CYP1A2
SCHEMBL25936841 0.72 ACP3 (0.62) HTTL3MBTL1MAPTALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0795559-B1 Substituted diphenylphosphanes and process for their production CELANESE CHEM EUROPE GMBH (DE) 2001-10-10 EP disclosed
US-5972825-A COMPLEX CATALYST FOR HYDROFORMYLATION OF OLEFIN CELANESE GMBH (DE) 1999-10-26 US disclosed
US-5801287-A Substituted diphenyldiphosphines and a process for their preparation AVENTIS RESEARCH & TECHNOLOGY GMBH & CO. KG (DE) 1998-09-01 US disclosed
EP-0795559-A1 Substituted diphenylphosphanes and process for their production HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-17 EP disclosed