SCHEMBL11085265

SCHEMBL11085265

CC1(OC(=O)O)CCC(N)CC1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
OPRL1 P41146 1/20 0.32
FFAR3 O14843 1/20 0.31
SCN1A P35498 1/20 0.31
SCN2A Q99250 1/20 0.31
SCN3A Q9NY46 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
SCHEMBL11567957 1.00 SLC1A2 (0.32) SLC1A2SLC1A1OPRL1FFAR3SCN1A
SCHEMBL21591911 0.83 SCN1A (0.31) SCN1ASCN2ASCN3A
Bromide SCHEMBL11569593 0.82 SCN1A (0.30) SCN1ASCN2ASCN3A
SCHEMBL8990538 0.81 CYP2C19 (0.34) FFAR3SCN1ASCN2ASCN3A
SCHEMBL3670104 0.79
SCHEMBL3267324 0.78 SCN1A (0.30) FFAR3SCN1ASCN2ASCN3A
SCHEMBL20541018 0.77
SCHEMBL14657993 0.77
SCHEMBL7946361 0.77
Hydrochloric Acid SCHEMBL4398568 0.77

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-0055145-B1 4-(AMINOMETHYL)CYCLOHEXANE-1-CARBOXYLIC ACID DERIVATIVES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1984-12-05 EP claimed
EP-0080334-B1 4-(N-(HYDROXYBENZYL)AMINOMETHYL)CYCLOHEXANE-1-CARBOXYLIC ACIDS KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1984-10-17 EP claimed