SCHEMBL3197312

SCHEMBL3197312

O=[PH](O)Oc1cccc(CCO)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.54
CYP4A11 Q02928 3/20 0.54
TDP1 Q9NUW8 1/20 0.41
TAAR1 Q96RJ0 1/20 0.39
ACHE P22303 3/20 0.38
ACMSD Q8TDX5 1/20 0.38
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
PLAU P00749 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
DAO P14920 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX5 P09917 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL13821225 0.81 ACHE (0.38) CYP4F2CYP4A11TAAR1ACHEMTNR1A
SCHEMBL28780318 0.81 CYP4F2 (0.36) CYP4F2CYP4A11ACHEALDH1A1
SCHEMBL27826209 0.81 ENPP2 (0.46) TAAR1ACHEALDH1A1
SCHEMBL18037123 0.81 SOD1 (0.48) TDP1KDM4EALDH1A1GAA
SCHEMBL3360899 0.78 PPARA (0.46) CYP4F2CYP4A11TDP1PPARAKDM4E
SCHEMBL10825545 0.74 FFAR1 (0.44) TDP1PPARGPPARAALDH1A1ALOX5
SCHEMBL43521 0.74 TAAR1 (0.67) CYP4F2CYP4A11TAAR1MTNR1AMTNR1B
SCHEMBL1852100 0.74 CYP4F2 (0.61) CYP4F2CYP4A11TDP1TAAR1ACHE
SCHEMBL2347947 0.73 CYP4F2 (0.69) CYP4F2CYP4A11TDP1DAOKDM4E
SCHEMBL10334435 0.73 CYP4F2 (0.69) CYP4F2CYP4A11TDP1TAAR1PPARG

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
US-7683106-B2 Primer for dental materials and pulp capping agent for dentin regeneration NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) 2010-03-23 US disclosed
EP-1226807-B1 DENTAL CURABLE COMPOSITION TOKUYAMA CORP (JP) 2008-08-13 EP disclosed
US-20060252846-A1 Primer for dental materials and pulp capping agent for dentin regeneration MITSUBISHI CHEMICAL CORPORATION (JP) 2006-11-09 US disclosed
US-6933327-B2 Dental curable composition TOKUYAMA CORPORATION (JP) 2005-08-23 US disclosed
US-20030036582-A1 Dental curable composition TOKUYAMA CORPORATION (JP) 2003-02-20 US disclosed
EP-1226807-A1 DENTAL CURABLE COMPOSITION TOKUYAMA CORPORATION (JP) 2002-07-31 EP disclosed