SCHEMBL6942643

SCHEMBL6942643

O=P(=O)c1ccc(P(c2ccc(P(=O)=O)cc2)c2ccc(P(=O)=O)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ESR1 P03372 2/20 0.39
ESR2 Q92731 2/20 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
SCHEMBL14540892 0.73 ACHE (0.50) TDP1
SCHEMBL1074337 0.71
SCHEMBL6358590 0.71 ALDH1A1 (0.41) CYP3A4TDP1ESR1ESR2
SCHEMBL16740409 0.69 TDP1 (0.50) CYP3A4TDP1ESR1ESR2
SCHEMBL16094788 0.67 TDP1 (0.92) CYP3A4TDP1ESR1ESR2
SCHEMBL1301471 0.67 TDP1 (0.92) CYP3A4TDP1ESR1ESR2
SCHEMBL2213574 0.65 CYP2A6 (0.50) CYP3A4TDP1
SCHEMBL152775 0.64 LMNA (0.57) CYP3A4TDP1ESR1ESR2
SCHEMBL196718 0.64 CYP3A4 (0.44) CYP3A4TDP1ESR1ESR2
SCHEMBL10882900 0.64 CYP3A4 (0.44) CYP3A4TDP1ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0876217-B1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF CATALYSTS BASED ON TRANSITION METAL AND PHOSPHINE RHODIA POLYAMIDE INTERMEDIATES (FR) 2003-10-15 EP claimed
US-5876587-A Electrochemical synthesis of transition metal/phosphine catalysts RHONE-POULENC CHIMIE (FR) 1999-03-02 US claimed
EP-0876214-A1 PROCESS FOR THE PREPARATION BY HYDROGENATION OF CATALYSTS BASED ON A TRANSITION METAL AND PHOSPHINE RHODIA FIBER & RESIN INTERMEDIATES (FR) 1998-11-11 EP claimed
EP-0876217-A1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF CATALYSTS BASED ON TRANSITION METAL AND PHOSPHINE RHODIA FIBER & RESIN INTERMEDIATES (FR) 1998-11-11 EP claimed
WO-1997024183-A1 PROCESS FOR THE PREPARATION BY HYDROGENATION OF CATALYSTS BASED ON A TRANSITION METAL AND PHOSPHINE RHODIA FIBER AND RESIN INTERMEDIATES (FR) 1997-07-10 WO claimed
WO-1997024184-A1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF CATALYSTS BASED ON TRANSITION METAL AND PHOSPHINE RHODIA FIBER AND RESIN INTERMEDIATES (FR) 1997-07-10 WO claimed
EP-0876217-B1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF CATALYSTS BASED ON TRANSITION METAL AND PHOSPHINE RHODIA POLYAMIDE INTERMEDIATES (FR) 2003-10-15 EP disclosed
EP-0854858-B1 ETHYLENICALLY UNSATURATED ORGANIC COMPOUND HYDROCYANATION METHOD RHODIA POLYAMIDE INTERMEDIATES (FR) 2001-06-13 EP disclosed
US-5876587-A Electrochemical synthesis of transition metal/phosphine catalysts RHONE-POULENC CHIMIE (FR) 1999-03-02 US disclosed
US-5856555-A WATER SOLUBILITY PHOSPHINE COMPOUND AND HYDROGEN CYANIDE RHONE-POULENC FIBER & RESIN INTERMEDIATES (FR) 1999-01-05 US disclosed
EP-0876217-A1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF CATALYSTS BASED ON TRANSITION METAL AND PHOSPHINE RHODIA FIBER & RESIN INTERMEDIATES (FR) 1998-11-11 EP disclosed
EP-0876214-A1 PROCESS FOR THE PREPARATION BY HYDROGENATION OF CATALYSTS BASED ON A TRANSITION METAL AND PHOSPHINE RHODIA FIBER & RESIN INTERMEDIATES (FR) 1998-11-11 EP disclosed
EP-0854858-A1 ETHYLENICALLY UNSATURATED ORGANIC COMPOUND HYDROCYANATION METHOD RHODIA FIBER & RESIN INTERMEDIATES (FR) 1998-07-29 EP disclosed
WO-1997024183-A1 PROCESS FOR THE PREPARATION BY HYDROGENATION OF CATALYSTS BASED ON A TRANSITION METAL AND PHOSPHINE RHODIA FIBER AND RESIN INTERMEDIATES (FR) 1997-07-10 WO disclosed
WO-1997024184-A1 PROCESS FOR THE ELECTROCHEMICAL PREPARATION OF CATALYSTS BASED ON TRANSITION METAL AND PHOSPHINE RHODIA FIBER AND RESIN INTERMEDIATES (FR) 1997-07-10 WO disclosed
WO-1997012857-A1 ETHYLENICALLY UNSATURATED ORGANIC COMPOUND HYDROCYANATION METHOD RHODIA FIBER AND RESIN INTERMEDIATES (FR) 1997-04-10 WO disclosed