SCHEMBL2361579

SCHEMBL2361579

CCCCCO[C@H]1CCC[C@@H](O)C1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 3/20 0.43
EPHX2 P34913 1/20 0.38
CNR2 P34972 12/20 0.38
NAAA Q02083 2/20 0.38

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
SCHEMBL2361353 1.00 GBA1 (0.43) GBA1EPHX2CNR2NAAA
SCHEMBL13954685 0.98 GBA1 (0.46) GBA1EPHX2CNR2NAAA
SCHEMBL14119588 0.98 GBA1 (0.46) GBA1EPHX2CNR2NAAA
SCHEMBL13455823 0.98 GBA1 (0.46) GBA1EPHX2CNR2NAAA
SCHEMBL10076752 0.95 CNR2 (0.36) GBA1EPHX2CNR2NAAA
SCHEMBL8970146 0.89 GBA1 (0.46) GBA1EPHX2
SCHEMBL11187287 0.87 GBA1 (0.48) GBA1EPHX2NAAA
SCHEMBL8970220 0.87 GBA1 (0.48) GBA1EPHX2NAAA
SCHEMBL8970521 0.87 GBA1 (0.48) GBA1EPHX2NAAA
SCHEMBL8969403 0.87 GBA1 (0.48) GBA1EPHX2NAAA

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-1786913-B1 METHOD FOR THE PRODUCTION OF DIARYLCYCLOALKYL DERIVATIVES SANOFI AVENTIS DEUTSCHLAND (DE) 2011-08-17 EP disclosed