SCHEMBL7542400

SCHEMBL7542400

CCCCCCCCCCCCCCCOC(=O)c1ccccc1N

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 1.00
HSD17B10 Q99714 7/20 1.00
KDM4E B2RXH2 3/20 1.00
POLB P06746 1/20 1.00
TSHR P16473 6/20 0.79
LMNA P02545 3/20 0.79
CYP3A4 P08684 4/20 0.76
MAPK1 P28482 3/20 0.76
TP53 P04637 2/20 0.76
L3MBTL1 Q9Y468 4/20 0.68
TDP1 Q9NUW8 3/20 0.68
NPC1 O15118 3/20 0.59
RAB9A P51151 3/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
MAPT P10636 3/20 0.59
HPGD P15428 2/20 0.59
GLA P06280 1/20 0.59
HIF1A Q16665 1/20 0.59
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57

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
SCHEMBL7540264 1.00 ALDH1A1 (1.00) ALDH1A1HSD17B10KDM4EPOLBTSHR
SCHEMBL7538114 1.00 ALDH1A1 (1.00) ALDH1A1HSD17B10KDM4EPOLBTSHR
SCHEMBL873445 1.00 ALDH1A1 (1.00) ALDH1A1HSD17B10KDM4EPOLBTSHR
SCHEMBL7539024 1.00 ALDH1A1 (1.00) ALDH1A1HSD17B10KDM4EPOLBTSHR
Heptyl 2-Aminobenzoate SCHEMBL7262823 1.00 ALDH1A1 (1.00) ALDH1A1HSD17B10KDM4EPOLBTSHR
SCHEMBL7539045 1.00 ALDH1A1 (1.00) ALDH1A1HSD17B10KDM4EPOLBTSHR
Hexyl 2-Aminobenzoate SCHEMBL4258769 1.00 ALDH1A1 (1.00) ALDH1A1HSD17B10KDM4EPOLBTSHR
SCHEMBL7539541 1.00 ALDH1A1 (1.00) ALDH1A1HSD17B10KDM4EPOLBTSHR
SCHEMBL7540254 1.00 ALDH1A1 (1.00) ALDH1A1HSD17B10KDM4EPOLBTSHR
SCHEMBL28794267 1.00 ALDH1A1 (1.00) ALDH1A1HSD17B10KDM4EPOLBTSHR

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-0852248-B1 A wire coat compound containing esters of aminobenzoic acid GOODYEAR TIRE & RUBBER (US) 2002-05-15 EP disclosed
US-5792800-A WITH A RUBBER, AND A METHYLENE DONOR AND ACCEPTOR; ADHESION PROMOTERS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1998-08-11 US disclosed
EP-0852248-A1 A wire coat compound containing esters of aminobenzoic acid THE GOODYEAR TIRE & RUBBER COMPANY (US) 1998-07-08 EP disclosed