SCHEMBL2780586

SCHEMBL2780586

CCCCCCCCCC(CCCCCCC)COP(=O)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
CYP3A4 P08684 1/20 0.47
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
CETP P11597 4/20 0.40

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
SCHEMBL25425420 1.00 L3MBTL1 (0.47) L3MBTL1CYP3A4PRSS1PRSS2PRSS3
SCHEMBL25422793 1.00 L3MBTL1 (0.47) L3MBTL1CYP3A4PRSS1PRSS2PRSS3
SCHEMBL25423360 1.00 L3MBTL1 (0.47) L3MBTL1CYP3A4PRSS1PRSS2PRSS3
SCHEMBL25421936 0.99 CYP3A4 (0.50) L3MBTL1CYP3A4PRSS1PRSS2PRSS3
SCHEMBL16345112 0.96 L3MBTL1 (0.46) L3MBTL1CYP3A4PRSS1PRSS2PRSS3
Octicizer SCHEMBL18301200 0.89 L3MBTL1 (0.64) L3MBTL1CYP3A4PRSS1PRSS2PRSS3
Octicizer SCHEMBL93483 0.89 L3MBTL1 (0.64) L3MBTL1CYP3A4PRSS1PRSS2PRSS3
Octicizer SCHEMBL28070819 0.87 L3MBTL1 (0.62) L3MBTL1CYP3A4PRSS1PRSS2PRSS3
SCHEMBL124717 0.86 CYP3A4 (0.64) L3MBTL1CYP3A4PRSS1PRSS2PRSS3
Octicizer SCHEMBL9798547 0.85 L3MBTL1 (0.59) L3MBTL1CYP3A4PRSS1PRSS2PRSS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7700807-B2 reacting a dichloromonophenyl phosphate and monochlorodiphenyl phosphate with an aliphatic alcohol, in the presence of a Lewis acid catalyst, in the absence of solvent, sparging the reaction mixture with an inert carrier gas to prodce monoalkyl diphenyl phosphate and dialkyl monophenyl phosphate SUPRESTA LLC (US) 2010-04-20 US disclosed
EP-1685141-B1 PROCESS TO PREPARE ALKYL PHENYL PHOSPHATES AKZO NOBEL NV (NL) 2010-01-06 EP disclosed
US-20070270616-A1 Durable Flame Retardant Finish for Cellulosic Materials SUPRESTA LLC (US) 2007-11-22 US disclosed
EP-1685141-A1 PROCESS TO PREPARE ALKYL PHENYL PHOSPHATES Akzo Nobel N.V. (NL) 2006-08-02 EP disclosed
WO-2005040177-A1 PROCESS TO PREPARE ALKYL PHENYL PHOSPHATES AKZO NOBEL N.V. (NL) 2005-05-06 WO disclosed
EP-1526137-A1 Process to prepare alkyl phenyl phosphates Akzo Nobel N.V. (NL) 2005-04-27 EP disclosed
US-6299887-B1 USED IN COSMETICS KAO CORPORATION (JP) 2001-10-09 US disclosed