SCHEMBL14282906

SCHEMBL14282906

CCCC(=O)[C@H](CS)NOC(=O)CCN1CCC(C(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PRCP P42785 6/20 0.44
BACE1 P56817 2/20 0.41
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
PKM P14618 1/20 0.38
NPY2R P49146 1/20 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
SCHEMBL14282939 0.91 BACE1 (0.46) PRCPBACE1NPY2R
SCHEMBL14282903 0.88 CHRM2 (0.47)
SCHEMBL14282925 0.80 OPRD1 (0.45)
SCHEMBL4253158 0.80 PRCP (0.55) PRCPBACE1CARM1PRMT6NPY2R
SCHEMBL4695183 0.77 PRCP (0.52) PRCPBACE1CARM1PRMT6PKM
SCHEMBL14282940 0.76 ALDH1A1 (0.52) PRCPNPY2R
SCHEMBL4072745 0.74 PRCP (0.49) PRCPBACE1CARM1PRMT6PKM
SCHEMBL12123733 0.73 PRCP (0.55) PRCPBACE1CARM1PRMT6
SCHEMBL14282941 0.73 PRCP (0.54) PRCPBACE1CARM1PRMT6
SCHEMBL14282923 0.71 OPRD1 (0.41)

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-7317026-B2 Sleep disorders; side effect reduction ; antihistamine antagonist HYPNION, INC. (US) 2008-01-08 US disclosed