SCHEMBL10806402

SCHEMBL10806402

C=C=CC(CCC(=O)OC)NC(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 19/20 0.46
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA7 P43166 1/20 0.37

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
SCHEMBL10805594 0.87 CTSK (0.47) CTSK
SCHEMBL22525433 0.84 CTSK (0.49) CTSKCA1CA2CA7
SCHEMBL18471584 0.82 CTSK (0.61) CTSKCA1CA2CA7
SCHEMBL22525990 0.82 CTSK (0.61) CTSKCA1CA2CA7
SCHEMBL10806809 0.75 CTSK (0.45) CTSKCA1CA2CA7
SCHEMBL23487152 0.75 CTSK (0.43) CTSKCA1CA2CA7
SCHEMBL13471217 0.75 CTSK (0.63) CTSKCA1CA2CA7
SCHEMBL31362911 0.75 CTSK (0.43) CTSKCA1CA2CA7
SCHEMBL3498487 0.75 CTSK (0.63) CTSKCA1CA2CA7
SCHEMBL21510806 0.74 CA2 (0.47) CTSKCA1CA2CA7

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-0134481-B1 GAMMA-ALLENYL-GAMMA-AMINOBUTYRIC ACIDS SYNTEX (U.S.A.) INC. (US) 1987-12-16 — — EP claimed
EP-0134481-B1 GAMMA-ALLENYL-GAMMA-AMINOBUTYRIC ACIDS SYNTEX (U.S.A.) INC. (US) 1987-12-16 — — EP disclosed
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