SCHEMBL7975873

SCHEMBL7975873

COc1c(O)c2ccc(NC(=O)c3ccccc3)cc2n(C)c1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
POLB P06746 1/20 0.50
BRD4 O60885 1/20 0.49
BRPF1 P55201 1/20 0.49
TP53 P04637 1/20 0.47
RAB9A P51151 5/20 0.47
NPC1 O15118 4/20 0.47
NLRP3 Q96P20 1/20 0.47
NTRK1 P04629 1/20 0.47
NGFR P08138 1/20 0.47
ATM Q13315 1/20 0.46
KCNK9 Q9NPC2 2/20 0.46
MAOB P27338 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL7997564 0.85 TP53 (0.50) MAPTPOLBTP53NPC1SMN1; SMN2
SCHEMBL8001907 0.84 SMN1; SMN2 (0.51) MAPTPOLBTP53RAB9ANPC1
SCHEMBL6579536 0.84 NR1H4 (0.48) TP53SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL7988822 0.81 TP53 (0.48) MAPTPOLBBRD4BRPF1TP53
SCHEMBL28825720 0.80 NTRK1 (0.53) MAPTPOLBBRD4BRPF1TP53
SCHEMBL6581059 0.80 MEN1 (0.46) POLBRAB9ANPC1MAOBHTT
SCHEMBL8001268 0.78 MEN1 (0.52) MAPTNPC1SMN1; SMN2MEN1KMT2A
SCHEMBL7997647 0.77 MEN1 (0.52) MAPTHTTSMN1; SMN2MEN1KMT2A
SCHEMBL19086870 0.76 NPC1 (0.53) MAPTPOLBBRD4BRPF1RAB9A
SCHEMBL6579540 0.76 KDM4E (0.43) MAPTSMN1; SMN2MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6271416-B1 O-(HYDROCARBONOXYACETAMIDO)BENZOIC ACID DERIVATIVES AS INTERMEDIATES DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-08-07 US disclosed
US-6136822-A ETHER, HYDROXY QUINOLINONE COMPOUNDS DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-10-24 US disclosed
EP-0927718-A1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-07-07 EP disclosed