SCHEMBL6836679

SCHEMBL6836679

CCCCCCCCO[CH]C[O]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 8/20 0.40
CA2 P00918 8/20 0.40
CA9 Q16790 7/20 0.40
LPAR3 Q9UBY5 3/20 0.40
CA12 O43570 3/20 0.40
CA7 P43166 3/20 0.40
CA14 Q9ULX7 3/20 0.40
LPAR1 Q92633 2/20 0.40
LPAR2 Q9HBW0 2/20 0.40
CA3 P07451 2/20 0.40
CA4 P22748 2/20 0.40
CA6 P23280 2/20 0.40
CA5A P35218 2/20 0.40
CA5B Q9Y2D0 2/20 0.40
NAAA Q02083 1/20 0.40
RECQL P46063 2/20 0.39
TSHR P16473 2/20 0.39
CES2 O00748 1/20 0.39
GLA P06280 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL7736690 1.00 CA1 (0.40) CA1CA2CA9LPAR3CA12
SCHEMBL7737401 0.90
SCHEMBL982044 0.80 THRB (0.42) CA1CA2CA9LPAR3CA12
SCHEMBL984576 0.80 THRB (0.42) CA1CA2CA9LPAR3CA12
SCHEMBL983446 0.80 THRB (0.42) CA1CA2CA9LPAR3CA12
SCHEMBL134426 0.80 THRB (0.42) CA1CA2CA9LPAR3CA12
SCHEMBL133829 0.80 THRB (0.42) CA1CA2CA9LPAR3CA12
SCHEMBL982845 0.80 THRB (0.42) CA1CA2CA9LPAR3CA12
SCHEMBL982532 0.80 THRB (0.42) CA1CA2CA9LPAR3CA12
SCHEMBL982824 0.80 THRB (0.42) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040137389-A1 Heat-developable light-sensitive material FUJIFILM CORPORATION (JP) 2004-07-15 US disclosed