SCHEMBL2149100

SCHEMBL2149100

CCCCOC1(c2ccccc2C)CN(C(=O)C(Cc2ccc(OC)cc2O)(OC(N)=O)C(C)(C)C)C1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MC1R Q01726 7/20 0.50
MC4R P32245 7/20 0.42
APP P05067 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
PLA2G2A P14555 2/20 0.32
GRIN2B Q13224 2/20 0.31
CNR2 P34972 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL2148833 0.88 MC1R (0.47) MC1RMC4RAPPGAAGRIN2B
SCHEMBL2148981 0.81 MC1R (0.40) MC1RMC4RMAPT
SCHEMBL2149032 0.79 MC1R (0.62) MC1RMC4RAPPGAAMAPT
SCHEMBL2149007 0.76 MC1R (0.37) MC1RMC4RAPPGAAGRIN2B
Trifluoroacetic Acid SCHEMBL1311384 0.75 MC1R (0.58) MC1RMC4RPOLB
SCHEMBL1311665 0.75 MC1R (0.58) MC1RMC4RAPPGAAMAPT
SCHEMBL16445351 0.75 MC1R (0.73) MC1RMC4RAPPGAAMAPT
SCHEMBL2149249 0.71 MC1R (0.49) MC1RMC4RAPPGRIN2B
SCHEMBL3731642 0.69 MC1R (0.47) MC1RMC4RAPPGRIN2B
SCHEMBL1311007 0.68 MC4R (0.42) MC1RMC4RAPPCNR2

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
EP-2342194-A1 OXOAZETIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS Galderma Research & Development (FR) 2011-07-13 EP disclosed