SCHEMBL7122618

SCHEMBL7122618

CCCCCCCCCOC([O])(C(C)C)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 8/20 0.35
CA2 P00918 8/20 0.35
CA9 Q16790 7/20 0.35
LPAR3 Q9UBY5 3/20 0.35
CA12 O43570 3/20 0.35
CA7 P43166 3/20 0.35
CA14 Q9ULX7 3/20 0.35
LPAR1 Q92633 2/20 0.35
LPAR2 Q9HBW0 2/20 0.35
CA3 P07451 2/20 0.35
CA4 P22748 2/20 0.35
CA6 P23280 2/20 0.35
CA5A P35218 2/20 0.35
CA5B Q9Y2D0 2/20 0.35
NAAA Q02083 1/20 0.35
CES2 O00748 2/20 0.35
RECQL P46063 2/20 0.34
GLA P06280 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL11614296 0.73 CES1 (0.40) CA1CA2CA9LPAR3CA12
SCHEMBL10878589 0.73 CES1 (0.40) CA1CA2CA9LPAR3CA12
SCHEMBL29018648 0.73 CA1 (0.43) CA1CA2CA9LPAR3CA12
SCHEMBL2808700 0.73 CA1 (0.39) CA1CA2CA9LPAR3CA12
SCHEMBL24450216 0.73 NAAA (0.41) LPAR3LPAR1LPAR2NAAACES2
SCHEMBL3520154 0.72 CA1 (0.32) CA1CA2CA9LPAR3CA12
SCHEMBL18944765 0.72 LPAR3 (0.41) CA1CA2CA9LPAR3CA12
SCHEMBL24830111 0.72 LPAR3 (0.41) CA1CA2CA9LPAR3CA12
SCHEMBL24829881 0.72 LPAR3 (0.41) CA1CA2CA9LPAR3CA12
SCHEMBL9349496 0.71 GGPS1 (0.47) CA1CA2CA9LPAR3LPAR1

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
EP-0675489-B1 Optical recording medium TDK CORP (JP) 2003-11-12 EP disclosed
EP-0675489-A1 Optical recording medium TDK Corporation (JP) 1995-10-04 EP disclosed