SCHEMBL9505701

SCHEMBL9505701

CCOP(=O)(O)O.c1ccc(P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
NPSR1 Q6W5P4 2/20 0.46
NR1I2 O75469 1/20 0.45
KCNH2 Q12809 1/20 0.44
CYP3A4 P08684 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ACHE P22303 1/20 0.42
ESR1 P03372 2/20 0.41
ESR2 Q92731 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TSHR P16473 2/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
SRC P12931 1/20 0.39
AOX1 Q06278 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39
CETP P11597 2/20 0.38

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
Diethyl Hydrogen Phosphate SCHEMBL27779642 0.89 TSHR (0.48) POLBNPSR1NR1I2KCNH2CYP3A4
Biphenyl SCHEMBL28234426 0.82 POLB (0.50) POLBNPSR1NR1I2KCNH2ACHE
SCHEMBL29176889 0.79 NR1I2 (0.50) POLBNPSR1NR1I2KCNH2ACHE
SCHEMBL7459362 0.79 CA12 (0.48) POLBNPSR1NR1I2KCNH2CYP3A4
Catechol SCHEMBL466512 0.79 POLB (0.46) POLBNPSR1NR1I2KCNH2CYP3A4
SCHEMBL9549811 0.78 USP2 (0.44) POLBKCNH2CYP3A4TDP1TSHR
Biphenyl SCHEMBL5865599 0.78 POLB (0.46) POLBNPSR1NR1I2KCNH2ACHE
Phenyl Dihydrogen Phosphate SCHEMBL10380848 0.78 SRC (0.70) POLBNPSR1NR1I2KCNH2ALDH1A1
Phosphoric Acid SCHEMBL8729168 0.77 CYP3A4 (0.67) CYP3A4TDP1ESR1ESR2MEN1
Phosphoric Acid SCHEMBL28562829 0.77 CYP3A4 (0.67) CYP3A4TDP1ESR1ESR2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0253405-B1 CATIONIC, ADVANCED EPOXY RESIN COMPOSITIONS THE DOW CHEMICAL COMPANY (US) 1993-08-11 EP disclosed
EP-0209174-B1 PROCESS FOR PREPARING ADVANCED EPOXY RESIN COMPOSITIONS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1992-03-04 EP disclosed
EP-0399351-A2 Epoxy resin and water borne coatings therefrom THE DOW CHEMICAL COMPANY (US) 1990-11-28 EP disclosed
US-4946911-A CONTAINING UNSATURATED IMIDE THE DOW CHEMICAL COMPANY (US) 1990-08-07 US disclosed
WO-1988000600-A1 CATIONIC, ADVANCED EPOXY RESIN COMPOSITIONS THE DOW CHEMICAL COMPANY (US) 1988-01-28 WO disclosed
EP-0209174-A2 Process for preparing advanced epoxy resin compositions SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1987-01-21 EP disclosed