SCHEMBL1712189

SCHEMBL1712189

CCCCCCc1ccccc1C(=O)OC(=O)c1cccc(N)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
HSD17B10 Q99714 3/20 0.50
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.50
BID P55957 3/20 0.45
MCL1 Q07820 3/20 0.45
PPARA Q07869 3/20 0.45
BCL2L1 Q07817 2/20 0.45
BAK1 Q16611 2/20 0.45
KAT8 Q9H7Z6 2/20 0.45
PPARG P37231 2/20 0.45
EP300 Q09472 1/20 0.45
KAT2A Q92830 1/20 0.45
KAT2B Q92831 1/20 0.45
KAT5 Q92993 1/20 0.45
SAE1 Q9UBE0 1/20 0.45
ALOX5 P09917 1/20 0.44
PTGS2 P35354 1/20 0.44
TSHR P16473 2/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL18395598 0.85 MMP2 (0.49) ALDH1A1HSD17B10KDM4EPOLBTSHR
SCHEMBL30656414 0.85 TSHR (0.53) ALDH1A1HSD17B10KDM4EPOLBBID
SCHEMBL570967 0.83 BID (0.54) ALDH1A1HSD17B10KDM4EBIDMCL1
SCHEMBL1712586 0.82 ALDH1A1 (0.43) ALDH1A1HSD17B10KDM4EPOLBBID
SCHEMBL28602250 0.82 ALDH1A1 (0.56) ALDH1A1HSD17B10KDM4EPOLBBID
SCHEMBL825447 0.82 BID (0.42) ALDH1A1HSD17B10KDM4EBIDMCL1
SCHEMBL29054012 0.82 PLK1 (0.43) ALDH1A1BIDMCL1PPARABCL2L1
SCHEMBL28993142 0.81 TSHR (0.42) ALDH1A1BIDMCL1PPARABCL2L1
SCHEMBL8512469 0.81 TSHR (0.51) ALDH1A1HSD17B10TSHRLMNATHRA
SCHEMBL1790208 0.80 TSHR (0.48) ALDH1A1BIDMCL1PPARABCL2L1

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
US-20120128609-A1 COSMETIC USE OF NATURAL EMULSIFIERS HallStar Italia S.r.l. (IT) 2012-05-24 US disclosed
EP-2344120-A1 COSMETIC USE OF NATURAL EMULSIFIERS B & T S.r.l. (IT) 2011-07-20 EP disclosed
WO-2010055533-A1 COSMETIC USE OF NATURAL EMULSIFIERS B & T S.R.L. (IT) 2010-05-20 WO disclosed