SCHEMBL14282904

SCHEMBL14282904

CCOC(=O)CN1CCC(=C(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 6/20 0.50
OPRK1 P41145 5/20 0.50
OPRM1 P35372 4/20 0.50
SETD7 Q8WTS6 1/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
KDM4E B2RXH2 1/20 0.45
HTR7 P34969 1/20 0.45
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TSHR P16473 1/20 0.44
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43

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
SCHEMBL4563119 0.86 OPRD1 (0.54) OPRD1OPRK1OPRM1SETD7MEN1
SCHEMBL11037050 0.82 OPRD1 (0.53) OPRD1OPRK1OPRM1SETD7MEN1
SCHEMBL4693977 0.81 TSHR (0.57) OPRD1OPRK1SETD7KMT2AKDM4E
SCHEMBL4257154 0.81 SETD7 (0.56) OPRD1OPRK1OPRM1SETD7HTR7
SCHEMBL11033476 0.80 OPRD1 (0.51) OPRD1OPRK1OPRM1SETD7MEN1
SCHEMBL3067438 0.79 BLM (0.57) MEN1KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL16481505 0.79 OPRD1 (0.54) OPRD1OPRK1OPRM1KDM4EHTR7
SCHEMBL11036336 0.78 SETD7 (0.53) OPRD1OPRK1OPRM1SETD7HTR7
Carbamic Acid SCHEMBL4082824 0.78 TSHR (0.53) OPRD1OPRK1SETD7KMT2AKDM4E
SCHEMBL14198385 0.77 SETD7 (0.65) OPRD1OPRK1OPRM1SETD7HTR7

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
US-7317026-B2 Sleep disorders; side effect reduction ; antihistamine antagonist HYPNION, INC. (US) 2008-01-08 US disclosed
US-7189757-B2 Treatment of sleep disorders using CNS target modulators HYPNION, INC. (US) 2007-03-13 US disclosed