SCHEMBL4447632

SCHEMBL4447632

CCCCCCCCCCCCCO[PH2]=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 8/20 0.43
CA2 P00918 8/20 0.43
CA9 Q16790 7/20 0.43
LPAR3 Q9UBY5 3/20 0.43
CA12 O43570 3/20 0.43
CA7 P43166 3/20 0.43
CA14 Q9ULX7 3/20 0.43
LPAR1 Q92633 2/20 0.43
LPAR2 Q9HBW0 2/20 0.43
CA3 P07451 2/20 0.43
CA4 P22748 2/20 0.43
CA6 P23280 2/20 0.43
CA5A P35218 2/20 0.43
CA5B Q9Y2D0 2/20 0.43
NAAA Q02083 1/20 0.43
TSHR P16473 2/20 0.42
THRB P10828 2/20 0.42
RECQL P46063 2/20 0.41
CES2 O00748 1/20 0.41
GLA P06280 1/20 0.41

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
Pentadecane SCHEMBL11673241 1.00 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL4444239 1.00 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL1228623 1.00 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL4453616 1.00 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL4445798 1.00 CA1 (0.43) CA1CA2CA9LPAR3CA12
Octane SCHEMBL10703294 1.00 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL1229752 1.00 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL11671569 1.00 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL4443799 1.00 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL6230049 1.00 CA1 (0.43) CA1CA2CA9LPAR3CA12

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-20090027586-A1 Thermoplastic Resin Composition, and Liquid Crystal Display Component Thereof or Information Recording Media Component Thereof POLYPLASTICS CO., LTD. (JP) 2009-01-29 US disclosed
EP-1992666-A1 THERMOPLASTIC RESIN COMPOSITION AND LIQUID CRYSTAL DISPLAY PART OR INFORMATION RECORDING MEDIUM PART USING THE COMPOSITION Polyplastics Co., Ltd. (JP) 2008-11-19 EP disclosed