SCHEMBL3887656

SCHEMBL3887656

O=[PH](O)OCC(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
CYP2D6 P10635 2/20 0.40
CYP1A2 P05177 1/20 0.40
PKM P14618 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KMT2A Q03164 1/20 0.39
CA7 P43166 1/20 0.39
HTR2A P28223 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
POLB P06746 1/20 0.38
SRC P12931 1/20 0.37
LMNA P02545 2/20 0.35
HRH1 P35367 1/20 0.35
MAPK1 P28482 1/20 0.35
MTNR1A P48039 1/20 0.35
MTNR1B P49286 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
SCHEMBL3887654 0.83 CA12 (0.42) CA12CA1CA2CA9CYP2D6
SCHEMBL2820605 0.82 TAAR1 (0.44) CYP2D6CYP1A2PKMSMN1; SMN2NPSR1
SCHEMBL28141976 0.82 SCN4A (0.52) CYP2D6CYP1A2PKMSMN1; SMN2NPSR1
SCHEMBL8885808 0.81 POLB (0.38) CA12CA1CA2CA9CYP2D6
SCHEMBL9569108 0.78 MTNR1A (0.46) CYP2D6CYP1A2PKMSMN1; SMN2NPSR1
Hydrochloric Acid SCHEMBL7378135 0.77 MTNR1A (0.45) CYP2D6CYP1A2PKMSMN1; SMN2NPSR1
SCHEMBL29286615 0.77 NPSR1 (0.40) CA12CA9CYP2D6CYP1A2SMN1; SMN2
SCHEMBL28799123 0.75 LMNA (0.45) SMN1; SMN2KMT2ALMNAMTNR1AMTNR1B
SCHEMBL28354710 0.74 POLB (0.46) CA12CA1CA2CA9CYP2D6
SCHEMBL28799168 0.73 KDM4E (0.50) SMN1; SMN2KMT2ALMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103180331-A Monohydroxy cyclic phosphonate substantially free of polyhydoxy phosphonate, process for making same and flame retardant flexible polyurethane foam obtained therefrom ICL IP AMERICA INC 2013-06-26 CN claimed
CN-103827169-B Polycarbonate and method for producing same CHEIL INDUSTRIES INC. (KR) 2016-04-13 CN disclosed
CN-103827169-A Polycarbonate and method for producing same CHEIL IND INC 2014-05-28 CN disclosed
CN-103180331-A Monohydroxy cyclic phosphonate substantially free of polyhydoxy phosphonate, process for making same and flame retardant flexible polyurethane foam obtained therefrom ICL IP AMERICA INC 2013-06-26 CN disclosed
US-7572303-B2 A symmetrical dialkyl carbonate, a metal, borong, silicon, or group 7 compound, a hydrogen or hydrocarbon-based fuel, an oxidizer, and a metallic cocatalyst; minimized hydrolysis; improved combustion and storage stability OCTANE INTERNATIONAL, LTD. (US) 2009-08-11 US disclosed
EP-0954558-B1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR WILLIAM C (US) 2006-06-14 EP disclosed
US-20050044778-A1 Fuel compositions employing catalyst combustion structure OCTANE INTERNATIONAL, LTD. 2005-03-03 US disclosed
US-20040237384-A1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2004-12-02 US disclosed
US-6652608-B1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2003-11-25 US disclosed
EP-1051461-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR, William C. (US) 2000-11-15 EP disclosed
WO-1999066009-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR WILLIAM C (US) 1999-12-23 WO disclosed
EP-0954558-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR, William C. (US) 1999-11-10 EP disclosed
WO-1998026028-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR WILLIAM C (US) 1998-06-18 WO disclosed
EP-0644206-B1 Olefin polymerization catalyst and process for preparing polyolefin SHOWA DENKO KK (JP) 1997-12-29 EP disclosed
EP-0644206-A1 Olefin polymerization catalyst and process for preparing polyolefin SHOWA DENKO KABUSHIKI KAISHA (JP) 1995-03-22 EP disclosed
US-5037908-A Process for polymerization of butene-1 TOA NENRYO KOGYO K.K. (JP) 1991-08-06 US disclosed
EP-0201647-B1 PROCESS FOR POLYMERIZATION OF BUTENE-1 Tonen Corporation (JP) 1990-12-27 EP disclosed
EP-0188914-B1 PROCESS FOR COPOLYMERIZATION OF ETHYLENE Tonen Corporation (JP) 1990-12-27 EP disclosed
EP-0201647-A1 Process for polymerization of butene-1 Tonen Corporation (JP) 1986-11-20 EP disclosed
EP-0188914-A2 Process for copolymerization of ethylene Tonen Corporation (JP) 1986-07-30 EP disclosed