SCHEMBL19624550

SCHEMBL19624550

C=C(C)C(=O)OCCOc1cc(-c2ccc(-c3ccc(C4CCC(C)CC4)cc3)cc2CC)ccc1CO

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.35
RARA P10276 2/20 0.32
RARB P10826 2/20 0.32
RARG P13631 2/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
FASN P49327 1/20 0.30

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
SCHEMBL19804402 0.92 FFAR4 (0.39) FFAR4RARARARBRARGCA1
SCHEMBL19796983 0.89 FFAR4 (0.34) FFAR4RARARARBRARG
SCHEMBL19624479 0.87 FFAR4 (0.33) FFAR4CA1CA2
SCHEMBL19804417 0.87 FFAR4 (0.38) FFAR4CA1CA2
SCHEMBL19804727 0.85 FFAR4 (0.39) FFAR4RARARARBRARGCA1
SCHEMBL19804377 0.84 EGFR (0.39) RARARARBRARG
SCHEMBL19804235 0.84 FFAR4 (0.37) FFAR4CA1CA2
SCHEMBL19624377 0.84 FFAR4 (0.34) FFAR4CA1CA2FASN
SCHEMBL19804647 0.84 FFAR4 (0.39) FFAR4RARARARBRARGCA1
SCHEMBL21097774 0.84 SRD5A2 (0.32) FFAR4RARARARBRARG

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
EP-3246305-A1 COMPOUND HAVING POLYMERIZABLE GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2017-11-22 EP disclosed