SCHEMBL8524697

SCHEMBL8524697

CCCCC(=O)N(C(=O)O)[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 6/20 0.44
AGTR1 P30556 2/20 0.44
CYP1A2 P05177 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 1/20 0.41
LMNA P02545 3/20 0.40
ALOX5 P09917 2/20 0.40
HSD17B10 Q99714 2/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
FAAH O00519 2/20 0.39

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
SCHEMBL8669014 0.89 EPHX2 (0.48) LMNAALOX5HSD17B10ALDH1A1CES2
SCHEMBL27422843 0.84 ALOX5 (0.44) LTB4R2AGTR1CYP1A2NPC1RAB9A
SCHEMBL27422841 0.84 ALOX5 (0.44) LTB4R2AGTR1CYP1A2NPC1RAB9A
SCHEMBL9754294 0.81 CYP1A2 (0.55) CYP1A2HSD17B10ALDH1A1
SCHEMBL9847074 0.79 TP53 (0.41) CYP1A2NPC1RAB9AALDH1A1
SCHEMBL4242811 0.79 AGTR1 (0.46) LTB4R2AGTR1ALOX5CES2CES1
SCHEMBL8615970 0.78 LPAR1 (0.54) ALOX5
SCHEMBL18426131 0.77 MMP2 (0.48) ALOX5
SCHEMBL18426129 0.77 MMP2 (0.48) ALOX5
SCHEMBL18425887 0.77 MMP2 (0.48) ALOX5

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-0749302-A4 HYDROXAMIC ACID AND CARBOXYLIC ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND USE THEREOF SANOFI WINTHROP INC (US) 1999-08-25 EP disclosed
EP-0749302-A1 HYDROXAMIC ACID AND CARBOXYLIC ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND USE THEREOF SANOFI WINTHROP, INC. (US) 1996-12-27 EP disclosed
WO-1995022966-A1 HYDROXAMIC ACID AND CARBOXYLIC ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND USE THEREOF SANOFI WINTHROP, INC. (US) 1995-08-31 WO disclosed