SCHEMBL17430744

SCHEMBL17430744

CC(C)CCN1CCC(CC(=O)O)CC1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.44
ARG2 P78540 1/20 0.44
CCR5 P51681 2/20 0.39
FFAR4 Q5NUL3 3/20 0.39
CHRM4 P08173 2/20 0.38
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
OPRL1 P41146 1/20 0.38
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
ANPEP P15144 1/20 0.37
ENPEP Q07075 1/20 0.37
OPRM1 P35372 1/20 0.36

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
SCHEMBL13934478 0.80 SMN1; SMN2 (0.46) FFAR4
SCHEMBL7392553 0.79 ARG1 (0.46) ARG1ARG2CCR5CHRM4OPRL1
SCHEMBL1381371 0.78 GBA1 (0.40) ARG1ARG2CHRM4OPRL1
SCHEMBL1381369 0.78 ARG1 (0.39) ARG1ARG2CCR5CHRM4OPRL1
SCHEMBL7327464 0.77 EPHX1 (0.47) CHRM4
SCHEMBL31072452 0.77 PRMT3 (0.49) ANPEPENPEP
SCHEMBL13960303 0.76 KCNA3 (0.66) CCR5OPRL1OPRM1
Hydrochloric Acid SCHEMBL23533426 0.76 GNAO1 (0.47) CHRM4
SCHEMBL12155298 0.76 CACNA1I (0.48) ITGB3ITGA2BOPRL1OPRM1
SCHEMBL23533551 0.76 KCNH2 (0.51)

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-20160007642-A1 OLIGOSACCHARIDE COMPOSITIONS AND METHODS FOR PRODUCING THEREOF MIDORI USA, INC. (US) 2016-01-14 US disclosed