SCHEMBL11419239

SCHEMBL11419239

CCCCCOP(=S)(Cl)Cl

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 14/20 0.58
LPAR2 Q9HBW0 11/20 0.58
LPAR1 Q92633 8/20 0.47
CYP3A4 P08684 1/20 0.42
LPAR6 P43657 3/20 0.39
LPAR4 Q99677 3/20 0.39
LPAR5 Q9H1C0 3/20 0.39
CA12 O43570 3/20 0.38
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CA9 Q16790 3/20 0.38
LMNA P02545 1/20 0.37
ESR1 P03372 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
CDC25A P30304 1/20 0.37
AGTR1 P30556 1/20 0.37
AKT1 P31749 1/20 0.37
ADRA1A P35348 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL11422055 0.92
SCHEMBL16879780 0.86 LPAR3 (0.69) LPAR3LPAR2LPAR1
SCHEMBL5852225 0.85 LPAR3 (0.58) LPAR3LPAR2LPAR1CYP3A4LPAR6
SCHEMBL8044300 0.83 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LPAR6
SCHEMBL5852206 0.83 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LPAR6
SCHEMBL2150299 0.83 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LPAR6
SCHEMBL11424957 0.81
SCHEMBL9500572 0.81 LPAR3 (0.65) LPAR3LPAR2LPAR1LPAR6LPAR4
SCHEMBL258312 0.79 LPAR3 (0.62) LPAR3LPAR2LPAR1CYP3A4LPAR6
SCHEMBL11861589 0.78 LPAR3 (0.55) LPAR3LPAR2LPAR1CYP3A4LPAR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4222930-A VULCANIZABLE RUBBER, SILICEOUS FILLER DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1980-09-16 US disclosed
US-4152347-A REINFORCING AGENTS IN VULCANIZABLE RUBBER MIXTURES WHICH CONTAIN A SILICA FILLER DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1979-05-01 US disclosed