SCHEMBL2148982

SCHEMBL2148982

CCCCOC1(c2ccccc2F)CN(C(=O)[C@@H](Cc2ccc(OC)cc2)NC(=O)OC(C)(C)C)C1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MC1R Q01726 8/20 0.57
MC4R P32245 7/20 0.57
HRH2 P25021 3/20 0.44
HRH1 P35367 3/20 0.44
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
PTPN1 P18031 3/20 0.41
KMT2A Q03164 2/20 0.41
PTPRA P18433 1/20 0.41
P2RX7 Q99572 1/20 0.41
HDAC8 Q9BY41 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
SCHEMBL16445371 0.89 MC1R (0.62) MC1RMC4RKMT2A
Trifluoroacetic Acid SCHEMBL1310165 0.82 MC1R (0.49) MC1RMC4RHDAC8
SCHEMBL1310104 0.81 MC1R (0.69) MC1RMC4RKMT2AHDAC8
SCHEMBL20450446 0.81 MC1R (0.69) MC1RMC4RKMT2AHDAC8
SCHEMBL16188227 0.81 MC1R (0.72) MC1RMC4RKMT2A
SCHEMBL1310666 0.80 MC1R (0.47) MC1RMC4RKMT2A
SCHEMBL16444996 0.79 MC1R (0.70) MC1RMC4RKMT2A
SCHEMBL2149298 0.79 MC1R (0.53) MC1RMC4RHRH2HRH1ALDH1A1
SCHEMBL2149537 0.77 KMT2A (0.46) MC1RMC4RHRH2HRH1ALDH1A1
SCHEMBL1312669 0.77 GPR119 (0.39) MC1RMC4RHDAC8

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
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
WO-2010052253-A1 OXOAZETIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-05-14 WO disclosed