SCHEMBL7048375

SCHEMBL7048375

O=C1Nc2ccc(F)c(C(F)(F)F)c2C(=NOC(=O)c2ccccc2)C1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.37
ALDH1A1 P00352 2/20 0.37
F2 P00734 1/20 0.37
HPGD P15428 1/20 0.37
ATM Q13315 1/20 0.37
MEN1 O00255 1/20 0.36
MAPK1 P28482 1/20 0.36
PLA2G7 Q13093 3/20 0.36
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP2C9 P11712 1/20 0.32
LRRK2 Q5S007 2/20 0.31
CES1 P23141 1/20 0.31
ABL1 P00519 1/20 0.31
CYP1A2 P05177 1/20 0.30

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
SCHEMBL7055743 0.91 KMT2A (0.37) KMT2AALDH1A1F2HPGDATM
SCHEMBL7048380 0.88 KMT2A (0.36) KMT2AALDH1A1F2HPGDATM
SCHEMBL7055733 0.88 CES1 (0.39) KMT2AALDH1A1F2HPGDATM
SCHEMBL7054407 0.84 GSK3A (0.31) CES1
SCHEMBL7051808 0.80 CES1 (0.36) KMT2AALDH1A1F2HPGDATM
SCHEMBL7048371 0.80 KMT2A (0.36) KMT2AALDH1A1F2HPGDATM
SCHEMBL7050411 0.78 KMT2A (0.37) KMT2AALDH1A1F2HPGDATM
SCHEMBL7054737 0.78 MAPT (0.36) KMT2AALDH1A1F2HPGDATM
SCHEMBL7054714 0.77 KMT2A (0.38) KMT2AALDH1A1F2HPGDATM
SCHEMBL7053797 0.77 KMT2A (0.36) KMT2AALDH1A1F2HPGDATM

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-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
EP-0706396-A4 1,2,3,4-TETRAHYDROQUINOLINE-2,3,4-TRIONE-3 OR 4-OXIMES AND USE OREGON STATE (US) 1998-12-09 EP disclosed
EP-0706396-A1 1,2,3,4-TETRAHYDROQUINOLINE-2,3,4-TRIONE-3 OR 4-OXIMES AND USE STATE OF OREGON ACTING BY AND THROUGH THE OREGON STATE BOARD OF HIGHER EDUCATION ON BEHALF OF OREGON STATE UNIVERSITY (US) 1996-04-17 EP disclosed
US-5475007-A Preventing convulsions THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1995-12-12 US disclosed
WO-1994027605-A1 1,2,3,4-TETRAHYDROQUINOLINE-2,3,4-TRIONE-3 OR 4-OXIMES AND USE STATE OF OREGON, ACTING BY AND THROUGH THE OREGON STATE BOARD OF HIGHER EDUCATION, ACTING FOR AND ON BEHALF OF THE OREGON HEALTH SCIENCES UNIVERSITY AND THE UNIVERSITY OF OREGON, EUGENE, OREGON (US) 1994-12-08 WO disclosed