SCHEMBL7987358

SCHEMBL7987358

N#CC=CC1CCCCC(=O)O1

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.31
CA9 Q16790 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
SCHEMBL10664603 0.84 CA1 (0.35) CA1CA9
SCHEMBL1960849 0.74 CA1 (0.31) CA1CA9
SCHEMBL320100 0.72 HTT (0.33) CA1CA9
SCHEMBL8898915 0.72 L3MBTL1 (0.34)
SCHEMBL25418582 0.72 CA1 (0.35) CA1CA9
SCHEMBL9667677 0.71 CA1 (0.39) CA1CA9
SCHEMBL1957701 0.69 CA1 (0.38) CA1CA9
SCHEMBL4787524 0.69 MAPT (0.50)
SCHEMBL17845981 0.66 CYP1A2 (0.44)
SCHEMBL5672189 0.66

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-6291655-B1 CONTAINING YTTRIUM; FOR POLYMERIZATION OF ETHYLENE BASF AKTIENGESELLSCHAFT (DE) 2001-09-18 US disclosed