SCHEMBL27780943

SCHEMBL27780943

CN1CCN(Cc2ccccc2)C(C(=O)C2CN(C)CCN2Cc2ccccc2)C1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.51
MC4R P32245 1/20 0.47
MAPT P10636 1/20 0.43
TACR1 P25103 1/20 0.42
GRM6 O15303 1/20 0.42
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL11476458 0.91 SIGMAR1 (0.51) SIGMAR1MC4RMAPTTACR1GRM6
SCHEMBL17919877 0.89 FKBP1A (0.47) SIGMAR1MC4R
SCHEMBL3306018 0.86 MEN1 (0.54) SIGMAR1
SCHEMBL17888459 0.86 SIGMAR1 (0.47) SIGMAR1MC4RMAPTTACR1
SCHEMBL25154270 0.79 SIGMAR1 (0.59) SIGMAR1MC4R
SCHEMBL25154734 0.79 SIGMAR1 (0.59) SIGMAR1MC4R
SCHEMBL14930169 0.78 MC4R (0.53) SIGMAR1MC4RMAPT
SCHEMBL27802501 0.77 MCHR1 (0.43) SIGMAR1MAPTGRM6
SCHEMBL24326317 0.77 SIGMAR1 (0.67) SIGMAR1MC4R
SCHEMBL3436828 0.77 SIGMAR1 (0.67) SIGMAR1MC4R

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
CN-101712655-B Acetamide derivative and application thereof in pharmacy YINLIN QIN 2012-05-23 CN disclosed
CN-101712655-A Acetamide derivative and application thereof in pharmacy YINLIN QIN 2010-05-26 CN disclosed