SCHEMBL2593867

SCHEMBL2593867

NC(=O)[C@@H](N)CCC(=O)C(N)CCC[C@H](N)[C]=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
ALOX15 P16050 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP2D6 P10635 1/20 0.32
NFKB1 P19838 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
NOD1 Q9Y239 1/20 0.31
GRM8 O00222 1/20 0.31
GRM6 O15303 1/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GSR P00390 1/20 0.31
CYP1A2 P05177 1/20 0.31
GRIK1 P39086 1/20 0.31
GRM5 P41594 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
SCHEMBL2590627 0.86 GSR (0.47) ALOX15BLMPMP22KMT2ANFKB1
SCHEMBL3951755 0.80 KMT2A (0.55) ALOX15BLMPMP22KMT2ANFKB1
SCHEMBL1509733 0.77 ALOX15 (0.43) ALOX15BLMPMP22KMT2ACYP2D6
SCHEMBL28041162 0.77 ALOX15 (0.33) ALOX15BLMPMP22KMT2ACYP2D6
SCHEMBL8051398 0.74 GSR (0.44) CHRM2CHRM4CHRM1ALOX15BLM
SCHEMBL10940176 0.72
SCHEMBL10944752 0.72
SCHEMBL11322855 0.71 CYP2D6 (0.34) CYP2D6NFKB1LMNAMAPT
SCHEMBL136970 0.71 GSR (0.60) ALOX15BLMPMP22KMT2ANFKB1
SCHEMBL22206267 0.71 GSR (0.60) ALOX15BLMPMP22KMT2ANFKB1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2563807-B1 POLYPEPTIDE EXPRESSED IN THE STRATUM CORNEUM AND USE THEREOF CENTRE NAT RECH SCIENT (FR) 2016-10-19 EP disclosed
EP-2563807-A1 POLYPEPTIDE EXPRESSED IN THE STRATUM CORNEUM AND USE THEREOF Chanel Parfums Beauté (FR) 2013-03-06 EP disclosed
WO-2011135253-A1 POLYPEPTIDE EXPRESSED IN THE STRATUM CORNEUM AND USE THEREOF CHANEL PARFUMS BEAUTE (FR) 2011-11-03 WO disclosed