SCHEMBL18901223

SCHEMBL18901223

CCC(/C=N\C)=C(/C)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
FNTA P49354 2/20 0.31
FNTB P49356 2/20 0.31
THRB P10828 1/20 0.31
PGGT1B P53609 1/20 0.31

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
SCHEMBL1823495 0.75 TDP1 (0.36) FFAR3ALDH1A1TDP1FNTAFNTB
SCHEMBL24420284 0.74
SCHEMBL3229730 0.73 ALDH1A1 (0.44) FFAR3ALDH1A1TDP1FNTAFNTB
SCHEMBL11809374 0.71 TSHR (0.41) FFAR3ALDH1A1TDP1FNTAFNTB
SCHEMBL11740585 0.71 TSHR (0.41) FFAR3ALDH1A1TDP1FNTAFNTB
SCHEMBL23532707 0.68 FNTA (0.42) FFAR3ALDH1A1TDP1FNTAFNTB
SCHEMBL20117248 0.64
SCHEMBL756883 0.63
SCHEMBL24439825 0.63
SCHEMBL222773 0.63 ALDH1A1 (0.44) FFAR3ALDH1A1TDP1FNTAFNTB

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-2274983-B1 HARMFUL ARTHROPOD CONTROL COMPOSITION, AND FUSED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL CO (JP) 2017-05-31 EP disclosed