SCHEMBL2886531

SCHEMBL2886531

ClP(Cl)c1c2ccccc2cc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.48
ALDH1A1 P00352 5/20 0.44
HSD17B10 Q99714 5/20 0.44
HIF1A Q16665 2/20 0.44
CYP1B1 Q16678 1/20 0.44
HTR2A P28223 1/20 0.43
CYP1A2 P05177 5/20 0.41
HPGD P15428 3/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
GLA P06280 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP3A4 P08684 1/20 0.40
ERBB2 P04626 1/20 0.40
FYN P06241 1/20 0.40
MAOA P21397 1/20 0.40
ACHE P22303 1/20 0.40
AHR P35869 1/20 0.40
TRPM4 Q8TD43 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
SCHEMBL18929709 0.79 ALDH1A1 (0.48) L3MBTL1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL2879337 0.71 TRPM4 (0.46) L3MBTL1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL5475228 0.71 CYP3A4 (0.48) L3MBTL1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL30413091 0.70 CYP2A6 (0.56) L3MBTL1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL632553 0.70 CYP2A6 (0.56) L3MBTL1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL11418253 0.70 ALDH1A1 (0.41) L3MBTL1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL2550564 0.70 ALDH1A1 (0.39) L3MBTL1ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL149754 0.69 ALDH1A1 (0.55) L3MBTL1ALDH1A1HSD17B10HIF1ACYP1B1
Anthracene SCHEMBL28833550 0.69 CYP2A6 (0.54) L3MBTL1ALDH1A1HSD17B10HIF1ACYP1B1
Triphenylene SCHEMBL28075721 0.68 HPRT1 (0.59) L3MBTL1ALDH1A1HSD17B10HIF1ACYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1354886-B1 Process for the preparation of tertiary phosphines SALTIGO GMBH (DE) 2009-08-26 EP claimed
US-7230136-B2 Reacting phosphorus halide with organomagnesium compound in presence of copper compound LANXESS DEUTSCHLAND GMBH (DE) 2007-06-12 US claimed
US-20030229240-A1 Reacting phosphorus halide with organomagnesium compound in presence of copper compound LANXESS DEUTSCHLAND GMBH (DE) 2003-12-11 US claimed
EP-1354886-A1 Process for the preparation of tertiary phosphines Bayer Aktiengesellschaft (DE) 2003-10-22 EP claimed
US-7847126-B2 prepared by reacting phosphorus halide with organomagnesium compound in presence of copper compound; di(tert-butyl)phenylphosphonium tetrafluoroborate, for example LANXESS DEUTSCHLAND GMBH (DE) 2010-12-07 US disclosed
EP-1354886-B1 Process for the preparation of tertiary phosphines SALTIGO GMBH (DE) 2009-08-26 EP disclosed
US-20070299273-A1 prepared by reacting phosphorus halide with organomagnesium compound in presence of copper compound; di(tert-butyl)phenylphosphonium tetrafluoroborate, for example LANXESS DEUTSCHLAND GMBH (DE) 2007-12-27 US disclosed
US-7230136-B2 Reacting phosphorus halide with organomagnesium compound in presence of copper compound LANXESS DEUTSCHLAND GMBH (DE) 2007-06-12 US disclosed
US-20030229240-A1 Reacting phosphorus halide with organomagnesium compound in presence of copper compound LANXESS DEUTSCHLAND GMBH (DE) 2003-12-11 US disclosed
EP-1354886-A1 Process for the preparation of tertiary phosphines Bayer Aktiengesellschaft (DE) 2003-10-22 EP disclosed