SCHEMBL28295885

SCHEMBL28295885

N=C(N)NCCCC(NC(=O)C(N)Cc1ccccc1)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCC(N)=O

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MC4R P32245 3/20 0.55
KISS1R Q969F8 13/20 0.55
OPRM1 P35372 1/20 0.54
OPRD1 P41143 1/20 0.54

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
SCHEMBL28295884 1.00 MC4R (0.55) MC4RKISS1ROPRM1OPRD1
SCHEMBL30464843 0.95 MC4R (0.55) MC4RKISS1ROPRM1OPRD1
SCHEMBL30464858 0.94 MC4R (0.52) MC4RKISS1ROPRM1OPRD1
SCHEMBL31541507 0.93 KISS1R (0.56) KISS1ROPRD1
SCHEMBL31249515 0.93 MC4R (0.55) MC4RKISS1R
SCHEMBL31249518 0.93 MC4R (0.55) MC4RKISS1R
SCHEMBL31249537 0.93 MC4R (0.55) MC4RKISS1R
SCHEMBL29419497 0.92 CCKBR (0.55) MC4RKISS1ROPRD1
SCHEMBL22117388 0.92 KISS1R (0.61) MC4RKISS1R
SCHEMBL22117389 0.92 KISS1R (0.61) MC4RKISS1R

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
CN-109715637-A Glucokinase activators and its application method 百时美施贵宝公司 2019-05-03 CN disclosed