SCHEMBL13822294

SCHEMBL13822294

CCOC(=O)[C@H](CCS(=O)(=O)O)NC(=O)c1ccccc1-c1ccccc1C

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
FNTA P49354 7/20 0.39
FNTB P49356 7/20 0.39
ICMT O60725 1/20 0.39
THRB P10828 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GAA P10253 1/20 0.38
TACR3 P29371 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CLPP Q16740 2/20 0.36

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
SCHEMBL13822309 0.91 THRB (0.46) MEN1KMT2ATHRBL3MBTL1GAA
SCHEMBL13822430 0.90 MEN1 (0.43) MEN1KMT2ACLPP
SCHEMBL13822299 0.90 MEN1 (0.43) MEN1KMT2AL3MBTL1GAATACR3
SCHEMBL2326177 0.90 CLPP (0.47) MEN1KMT2AL3MBTL1GAACLPP
SCHEMBL13822328 0.89 KMT2A (0.42) MEN1KMT2ACLPP
SCHEMBL13822284 0.89 KMT2A (0.42) MEN1KMT2AL3MBTL1TACR3TDP1
SCHEMBL13822329 0.89 MEN1 (0.42) MEN1KMT2ATACR3CLPP
SCHEMBL13822599 0.88 ALDH1A1 (0.42) MEN1KMT2AL3MBTL1GAATDP1
SCHEMBL13822597 0.88 KMT2A (0.41) MEN1KMT2ACLPP
SCHEMBL13822310 0.88 TAS1R3 (0.44) MEN1KMT2ATACR3TDP1

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-2524686-B1 PIGMENTATION-PREVENTING OR -AMELIORATING AGENT POLA CHEM IND INC (JP) 2017-06-21 EP disclosed
EP-2524686-A1 PIGMENTATION-PREVENTING OR -AMELIORATING AGENT Pola Chemical Industries Inc. (JP) 2012-11-21 EP disclosed