SCHEMBL7051545

SCHEMBL7051545

O=C1Nc2cc(Cl)c(Cl)c(Cl)c2C(=NOC(=O)c2ccccc2)C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.39
HPGD P15428 4/20 0.39
ALDH1A1 P00352 3/20 0.39
F2 P00734 1/20 0.39
ATM Q13315 1/20 0.39
MEN1 O00255 2/20 0.38
MAPK1 P28482 1/20 0.38
CYP2C9 P11712 1/20 0.38
GAA P10253 2/20 0.38
TGM2 P21980 1/20 0.36
MAPT P10636 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
CES1 P23141 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
LMNA P02545 1/20 0.34
NPC1 O15118 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
HSP90AA1 P07900 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
SCHEMBL7051654 0.91 KMT2A (0.39) KMT2AHPGDALDH1A1F2ATM
SCHEMBL7051535 0.87 CES1 (0.48) KMT2AHPGDALDH1A1F2ATM
SCHEMBL8871643 0.86 MAPT (0.38) KMT2AHPGDALDH1A1F2ATM
SCHEMBL7051070 0.86 MAPT (0.38) KMT2AHPGDALDH1A1F2ATM
SCHEMBL7054835 0.83 CES1 (0.47) KMT2AHPGDALDH1A1F2ATM
SCHEMBL7054180 0.82 HPGD (0.37) KMT2AHPGDALDH1A1F2ATM
SCHEMBL7053378 0.82 CES1 (0.39) ALDH1A1TGM2MAPTCES1LMNA
SCHEMBL7051548 0.80 CES1 (0.48) KMT2AHPGDALDH1A1F2ATM
SCHEMBL7054980 0.80 MAPT (0.38) KMT2AHPGDALDH1A1F2ATM
SCHEMBL7051552 0.79 CES1 (0.47) KMT2AHPGDALDH1A1F2ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0706396-B1 1,2,3,4-TETRAHYDROQUINOLINE-2,3,4-TRIONE-3 OR 4-OXIMES AND USE OREGON STATE (US) 2003-05-02 EP disclosed
US-5652368-A NERVOUS SYSTEM DISORDERS, ALZHEIMER'S DISEASE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1997-07-29 US disclosed