SCHEMBL17834246

SCHEMBL17834246

CCCC(CCC)C(OC)OC

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.32

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
SCHEMBL10709046 0.78
SCHEMBL9202044 0.73
SCHEMBL5611390 0.73 METAP1 (0.34) METAP1
SCHEMBL13890682 0.73 TSHR (0.33) METAP1
SCHEMBL7902477 0.73 CA2 (0.39)
SCHEMBL5473438 0.71 METAP1 (0.41) METAP1
Ammonia Solution, Strong SCHEMBL27526315 0.71 CA2 (0.38)
Water SCHEMBL28143422 0.71 CA2 (0.38)
SCHEMBL39315 0.71 OPRM1 (0.31) METAP1
SCHEMBL22817582 0.71

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-20160166705-A1 THERAPEUTICAL USE OF TERNARY COMPLEXES OF VALPROIC ACID CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2016-06-16 US disclosed