SCHEMBL990591

SCHEMBL990591

CC(C)(C)C(Cl)OP(=O)(O)O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.33
LMNA P02545 1/20 0.32
FDPS P14324 2/20 0.31
BLM P54132 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL990589 0.79
SCHEMBL28529710 0.77 CYP2C19 (0.34) SMPD1LMNAFDPSBLMTDP1
SCHEMBL29248119 0.76 SMPD1 (0.31) SMPD1LMNA
SCHEMBL23633165 0.76 SMPD1 (0.32) SMPD1
SCHEMBL3892285 0.74 SMPD1 (0.35) SMPD1LMNAFDPSBLMTDP1
SCHEMBL27757592 0.72 LAP3 (0.35) SMPD1FDPSBLMTDP1
SCHEMBL466569 0.72 LAP3 (0.35) SMPD1LMNAFDPSBLMTDP1
SCHEMBL538990 0.71
SCHEMBL4940649 0.70
SCHEMBL11151287 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0008939-B1 INTUMESCENT COMPOSITION GREAT LAKES CHEMICAL CORPORATION (US) 1983-02-16 EP claimed
US-4345002-A CYCLIC NITROGEN COMPOUND, HYDROXY CONTAINING ORGANO-PHOSPHORUS COMPOUND, AND A PHOSPHORUS CONTAINING ACID GREAT LAKES CHEMICAL CORPORATION (US) 1982-08-17 US claimed
US-4241145-A TRIAMINO-TRIAZINE, COPOLYCONDENSED VINYLPHOSPHONATE, A PHOSPHORUS-CONTAINING ACID AND WATER FIREPROOF WOOD SUBSTRATES VELSICOL CHEMICAL CORPORATION (US) 1980-12-23 US claimed
EP-0008939-A2 Intumescent composition GREAT LAKES CHEMICAL CORPORATION (US) 1980-03-19 EP claimed
EP-2448950-A1 SYNTHESIS OF N4- (2, 2-DIMETHYL-4- [ (DIHYDROGEN PHOSPHONOXY]-3-OXO-5-PYRIDO [1, 4]OXAZIN-6-YL)-5-FLUORO-N2- (3, 4, 5,-TRIMETHOXYPHENYL) -2, 4- PYRIMIDINEDIAMINE DISODIUM SALT Rigel Pharmaceuticals, Inc. (US) 2012-05-09 EP disclosed
WO-2011002999-A1 SYNTHESIS OF N4- (2, 2-DIMETHYL-4- [ (DIHYDROGEN PHOSPHONOXY ] -3-OXO-5-PYRIDO [1, 4] OXAZIN-6-YL)-5-FLUORO-N2- (3, 4, 5,-TRIMETHOXYPHENYL) -2, 4- PYRIMIDINEDIAMINE DISODIUM SALT RIGEL PHARMACEUTICALS, INC. (US) 2011-01-06 WO disclosed
EP-0008939-B1 INTUMESCENT COMPOSITION GREAT LAKES CHEMICAL CORPORATION (US) 1983-02-16 EP disclosed
US-4345002-A CYCLIC NITROGEN COMPOUND, HYDROXY CONTAINING ORGANO-PHOSPHORUS COMPOUND, AND A PHOSPHORUS CONTAINING ACID GREAT LAKES CHEMICAL CORPORATION (US) 1982-08-17 US disclosed
EP-0008939-A2 Intumescent composition GREAT LAKES CHEMICAL CORPORATION (US) 1980-03-19 EP disclosed