SCHEMBL27846137

SCHEMBL27846137

CCCCOC1(c2ccccc2C)CN(C(=O)[C@@H](Cc2ccc(OC)cc2)NC(=O)CC(C(N)=O)C2N=NC(C)=N2)C1

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MC1R Q01726 9/20 0.74
MC4R P32245 9/20 0.74
MC5R P33032 1/20 0.33
MC3R P41968 1/20 0.33
MMP1 P03956 2/20 0.32
KMT2A Q03164 2/20 0.32
ITGB1 P05556 1/20 0.32
ITGA4 P13612 1/20 0.32
PTPN1 P18031 1/20 0.32
CYP51A1 Q16850 1/20 0.31
P2RY12 Q9H244 1/20 0.31
APP P05067 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL1311438 0.85 MC4R (1.00) MC1RMC4RMC5RMC3RPTPN1
SCHEMBL20450373 0.85 MC4R (1.00) MC1RMC4RMC5RMC3RPTPN1
SCHEMBL16188227 0.82 MC1R (0.72) MC1RMC4RMC5RMC3RMMP1
SCHEMBL16444996 0.80 MC1R (0.70) MC1RMC4RMC5RMC3RKMT2A
SCHEMBL14360403 0.80 MC4R (0.71) MC1RMC4RMC5RMC3RKMT2A
SCHEMBL1310203 0.78 MC1R (0.65) MC1RMC4RMC5RMC3RMMP1
SCHEMBL20450424 0.78 MC1R (0.65) MC1RMC4RMC5RMC3RMMP1
SCHEMBL1310622 0.78 MC1R (0.65) MC1RMC4RMC5RMC3RMMP1
SCHEMBL1325753 0.78 MC1R (0.64) MC1RMC4RMC5RMC3RMMP1
SCHEMBL2154629 0.78 MC1R (0.83) MC1RMC4RMC5RMC3RPTPN1

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-102203081-A Oxoazetidine derivatives, method for the production thereof and use thereof in human medicine and cosmetics GALDERMA RES & DEV 2011-09-28 CN claimed
CN-102203081-A Oxoazetidine derivatives, method for the production thereof and use thereof in human medicine and cosmetics GALDERMA RES & DEV 2011-09-28 CN disclosed