SCHEMBL7048288

SCHEMBL7048288

O=C1Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2C(=O)C1=NOC(=O)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 3/20 0.36
F2 P00734 1/20 0.36
ATM Q13315 1/20 0.36
MEN1 O00255 1/20 0.36
MAPK1 P28482 1/20 0.36
GALR3 O60755 1/20 0.35
MAPT P10636 5/20 0.35
LMNA P02545 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
P2RX1 P51575 1/20 0.33
KDR P35968 1/20 0.33
LRRK2 Q5S007 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
SLC6A9 P48067 1/20 0.32
SCN8A Q9UQD0 1/20 0.32
SCN10A Q9Y5Y9 1/20 0.32

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
SCHEMBL7050411 0.93 KMT2A (0.37) KMT2AALDH1A1HPGDF2ATM
SCHEMBL7054322 0.88 HPGD (0.37) KMT2AALDH1A1HPGDF2ATM
SCHEMBL7051756 0.88 KMT2A (0.35) KMT2AALDH1A1HPGDF2ATM
SCHEMBL7048278 0.83 GALR3 (0.32) ALDH1A1HPGDGALR3MAPTKDR
SCHEMBL7053797 0.83 KMT2A (0.36) KMT2AALDH1A1HPGDF2ATM
SCHEMBL7054180 0.83 HPGD (0.37) KMT2AALDH1A1HPGDF2ATM
SCHEMBL7052760 0.79 MAPT (0.36) KMT2AALDH1A1HPGDF2ATM
SCHEMBL7053186 0.79 MAPT (0.36) KMT2AALDH1A1HPGDF2ATM
SCHEMBL7050946 0.79 MAPT (0.36) KMT2AALDH1A1HPGDF2ATM
SCHEMBL7054941 0.79 KMT2A (0.38) KMT2AALDH1A1HPGDF2ATM

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 6 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
US-5652368-A NERVOUS SYSTEM DISORDERS, ALZHEIMER'S DISEASE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1997-07-29 US 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