SCHEMBL11070610

SCHEMBL11070610

COC(=O)C1(CCOCCCCC2CCCCCC2)CO1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.44
NAAA Q02083 14/20 0.43
FKBP1A P62942 1/20 0.40

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
SCHEMBL11079057 1.00 EPHX1 (0.44) EPHX1NAAAFKBP1A
SCHEMBL11079388 0.92 EPHX1 (0.41) EPHX1NAAAFKBP1A
SCHEMBL11078952 0.92 FKBP1A (0.36) EPHX1NAAAFKBP1A
SCHEMBL11074544 0.92 ALDH1A1 (0.35) EPHX1NAAAFKBP1A
SCHEMBL11068141 0.91 FKBP1A (0.39) EPHX1NAAAFKBP1A
SCHEMBL11073629 0.89 EPHX1 (0.41) EPHX1NAAAFKBP1A
SCHEMBL11076567 0.89 EPHX1 (0.41) EPHX1NAAAFKBP1A
SCHEMBL11070926 0.89 EPHX1 (0.41) EPHX1NAAAFKBP1A
SCHEMBL11074335 0.88 ABCB11 (0.38) EPHX1NAAAFKBP1A
SCHEMBL11072205 0.88 NAAA (0.36) EPHX1NAAAFKBP1A

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-4430339-A PROPHYLAXIS, METABOLISM, GLUCOSE, FATS, HYPOGLYCEMIC AGENTS BYK GULDEN LOMBERG CHEMISCHE FABRIK GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1984-02-07 US disclosed