SCHEMBL27388239

SCHEMBL27388239

NC(=O)c1ccccc1C(=O)NOONC(=O)c1ccccc1C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 2/20 0.50
MAPT P10636 1/20 0.50
TSHR P16473 1/20 0.50
HSD17B10 Q99714 1/20 0.50
METAP2 P50579 1/20 0.47
CTNNB1 P35222 1/20 0.46
BCAT2 O15382 1/20 0.45
IRAK4 Q9NWZ3 1/20 0.44
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
GAA P10253 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
SIRT2 Q8IXJ6 2/20 0.40
CA1 P00915 1/20 0.40
CA9 Q16790 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KEAP1 Q14145 1/20 0.40

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
SCHEMBL17766647 0.82 ALDH1A1 (0.54) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL39118 0.81 ALDH1A1 (0.70) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL27700719 0.81 ALDH1A1 (0.70) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL4967588 0.81 ALDH1A1 (0.70) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL4138337 0.80 CTSD (0.55) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL1520940 0.80 KDM4E (0.59) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL29872360 0.80 KDM4E (0.59) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL30064209 0.78 GAA (0.59) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL4666198 0.78 GAA (0.59) KDM4EALDH1A1HPGDMAPTTSHR
Hydrochloric Acid SCHEMBL11553883 0.78 CTSD (0.53) KDM4EALDH1A1HPGDMAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1074237-A Bleach activation UNILEVER NV (NL) 1993-07-14 CN disclosed