SCHEMBL9210243

SCHEMBL9210243

CCOC(=O)CCCCCCCC(=O)N(CCCCCCN(C(=O)CCCCCCCC(=O)OCC)C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 10/20 0.40
ALOX5 P09917 1/20 0.38
ALDH1A1 P00352 2/20 0.38
ALOX15 P16050 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
USP2 O75604 1/20 0.38
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
DNM1 Q05193 1/20 0.35
AMPD2 Q01433 1/20 0.33
GAA P10253 1/20 0.33
DGKA P23743 1/20 0.33

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
SCHEMBL9209250 1.00 EPHX2 (0.40) EPHX2ALOX5ALDH1A1ALOX15TDP1
SCHEMBL9205591 0.94 EPHX2 (0.36) EPHX2ALOX5ALDH1A1ALOX15TDP1
SCHEMBL9206833 0.87 GAA (0.37) EPHX2ALDH1A1ALOX15GAA
SCHEMBL8430751 0.87 KDM5A (0.38) EPHX2
SCHEMBL536568 0.84 KDM5A (0.35) EPHX2ALDH1A1ALOX15GAA
SCHEMBL11059443 0.82 EPHX2 (0.37) EPHX2ALDH1A1ALOX15TDP1TSHR
SCHEMBL8432720 0.82 ALDH1A1 (0.34) ALDH1A1ALOX15GAA
SCHEMBL8535439 0.82 EPHX2 (0.36) EPHX2ALOX5ALDH1A1ALOX15TDP1
SCHEMBL13297927 0.81 PAOX (0.33) ALOX15
SCHEMBL9210174 0.80 ALDH1A1 (0.33) ALDH1A1ALOX15GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0434079-B1 N,N'-hydrocarbylenebis(N-hals-substituted amic acid hydrazides) and their derivatives ATOCHEM NORTH AMERICA (US) 1995-09-20 EP disclosed
US-5132387-A Polyme bound ELF ATOCHEM NORTH AMERICA, INC. (US) 1992-07-21 US disclosed
EP-0494639-A2 Hindered amine light stabilizer hydrazides for stabilizing polyurethane, polyurea and polyurethane-polyurea polymers ELF ATOCHEM NORTH AMERICA, INC. (US) 1992-07-15 EP disclosed
US-5043372-A Light stabilizers for polyolefins; reacting hydrazine with bis(half ester-half amide) ATOCHEM NORTH AMERICA, INC. (US) 1991-08-27 US disclosed
EP-0434079-A1 N,N'-hydrocarbylenebis(N-hals-substituted amic acid hydrazides) and their derivatives ELF ATOCHEM NORTH AMERICA, INC. (US) 1991-06-26 EP disclosed