SCHEMBL2576486

SCHEMBL2576486

c1ccc(N(c2ccccc2)P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.43
CYP3A4 P08684 2/20 0.43
ALDH1A1 P00352 6/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ALOX15 P16050 1/20 0.35
ESR1 P03372 4/20 0.33
ESR2 Q92731 4/20 0.33
MAPT P10636 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 2/20 0.33
HTT P42858 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
GAA P10253 2/20 0.31
HPGD P15428 2/20 0.31
CTSD P07339 1/20 0.30

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
SCHEMBL16755617 0.78 TDP1 (0.43) TDP1CYP3A4ALDH1A1NPSR1ALOX15
SCHEMBL23331775 0.77 ESR1 (0.47) CYP3A4ALDH1A1ESR1ESR2MEN1
SCHEMBL2574194 0.76 MEN1 (0.42) TDP1CYP3A4ALDH1A1NPSR1ALOX15
SCHEMBL11063406 0.74 CYP3A4 (0.39) TDP1CYP3A4ALDH1A1NPSR1ALOX15
SCHEMBL28635021 0.73 TDP1 (0.50) TDP1CYP3A4ALDH1A1ESR1ESR2
SCHEMBL11080870 0.73 KMT2A (0.43) TDP1CYP3A4ALDH1A1NPSR1ALOX15
SCHEMBL9715912 0.72 CYP3A4 (0.33) TDP1CYP3A4ESR1ESR2
SCHEMBL14938874 0.72 TDP1 (0.38) TDP1CYP3A4ALDH1A1NPSR1ALOX15
SCHEMBL3305686 0.72 CYP3A4 (0.38) TDP1CYP3A4ALDH1A1NPSR1ALOX15
SCHEMBL32679515 0.71 CYP3A4 (0.47) TDP1CYP3A4ALDH1A1ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1312162-C Organic phosphine compound with both hole and electron channel structure and its oxide and prepn process UNIV FUDAN (CN) 2007-04-25 CN claimed
CN-1706852-A Organic phosphine compound with both hole and electron channel structure and its oxide and prepn process UNIV FUDAN (CN) 2005-12-14 CN claimed
EP-1466946-B1 FLAME-RETARDANT RESIN COMPOSITION POLYPLASTICS CO (JP) 2011-11-09 EP disclosed
CN-1312162-C Organic phosphine compound with both hole and electron channel structure and its oxide and prepn process UNIV FUDAN (CN) 2007-04-25 CN disclosed
US-7205346-B2 halogen-free, fireproof mixture of thermoplastic resins, containing phosphorus compounds, aromatic resins, nitrogen compounds, metal compounds, stabilizer agents and water repellants POLYPLASTICS CO., LTD. (JP) 2007-04-17 US disclosed
CN-1706852-A Organic phosphine compound with both hole and electron channel structure and its oxide and prepn process UNIV FUDAN (CN) 2005-12-14 CN disclosed
US-20040254270-A1 Flame-retardant resin composition POLYPLASTICS CO., LTD. (JP) 2004-12-16 US disclosed
EP-1466946-A1 FLAME-RETARDANT RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2004-10-13 EP disclosed