SCHEMBL6561892

SCHEMBL6561892

CCCCCCCCCCCCOP(=O)(Cl)Cl

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 11/20 0.61
LPAR2 Q9HBW0 7/20 0.61
LPAR1 Q92633 6/20 0.61
CYP3A4 P08684 1/20 0.52
TP53 P04637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 1/20 0.48
ESR1 P03372 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
CDC25A P30304 1/20 0.48
AGTR1 P30556 1/20 0.48
AKT1 P31749 1/20 0.48
ADRA1A P35348 1/20 0.48
KCNH2 Q12809 1/20 0.48
LPAR5 Q9H1C0 1/20 0.42

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
SCHEMBL11297315 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4TP53
SCHEMBL11289118 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4TP53
SCHEMBL29151408 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4TP53
SCHEMBL3129987 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4TP53
SCHEMBL11292235 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4TP53
SCHEMBL11290063 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4TP53
SCHEMBL25170776 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4TP53
SCHEMBL6263500 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4TP53
SCHEMBL1261030 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4TP53
SCHEMBL7550122 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4257996-A PRESSING PARTICLES HAVING REACTIVE GROUPS THE UPJOHN COMPANY (US) 1981-03-24 US claimed
EP-1154778-B1 PHARMACEUTICAL PREPARATION CONTAINING DITHRANOL ESPARMA GMBH (DE) 2004-05-12 EP disclosed
US-6413950-B1 TOPICAL APPLICATION; SKIN DISORDERS ESPARMA GMBH (DE) 2002-07-02 US disclosed
US-5780504-A Topical alkyl-2-O-L-ascorbyl-phosphates AVON PRODUCTS, INC. (US) 1998-07-14 US disclosed
US-5607968-A Topical alkyl-2-O-L-ascorbyl-phosphates AVON PRODUCTS, INC. (US) 1997-03-04 US disclosed
US-4257996-A PRESSING PARTICLES HAVING REACTIVE GROUPS THE UPJOHN COMPANY (US) 1981-03-24 US disclosed
US-4256741-A INSECTICIDES, MITICIDES, APHIDICIDES VELSICOL CHEMICAL CORPORATION (US) 1981-03-17 US disclosed
US-4226859-A INSECTICIDES VELSICOL CHEMICAL CORPORATION (US) 1980-10-07 US disclosed