SCHEMBL6576810

SCHEMBL6576810

CCOCC(=O)N(C/C=C(\C)CCC=C(C)C)c1cc(N)ccc1C(=O)OCC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.38
LMNA P02545 2/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAOA P21397 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
SCHEMBL6576816 1.00 TRPV1 (0.38) TRPV1LMNAMEN1NPC1ALDH1A1
SCHEMBL6578891 0.92 MAOB (0.38) TRPV1ALDH1A1GAAMAPTHSD17B10
SCHEMBL6578885 0.92 MAOB (0.38) TRPV1ALDH1A1GAAMAPTHSD17B10
SCHEMBL6579381 0.90 ALDH1A1 (0.35) TRPV1LMNANPC1ALDH1A1MAPT
SCHEMBL6579376 0.90 ALDH1A1 (0.35) TRPV1LMNANPC1ALDH1A1MAPT
SCHEMBL6579348 0.85 SMN1; SMN2 (0.45) TRPV1LMNAMEN1ALDH1A1MAPT
SCHEMBL6579338 0.85 SMN1; SMN2 (0.45) TRPV1LMNAMEN1ALDH1A1MAPT
SCHEMBL6579384 0.84 TRPV1 (0.39) TRPV1ALDH1A1ALOX15
SCHEMBL6579387 0.84 TRPV1 (0.39) TRPV1ALDH1A1ALOX15
SCHEMBL6581186 0.83 TRPV1 (0.43) TRPV1ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0927718-B1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK & CHEMICALS (JP) 2004-02-25 EP disclosed
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