SCHEMBL6582345

SCHEMBL6582345

CCCCN(C(=O)COc1ccc(O)cc1)c1cc(NCC=C(C)CCC=C(C)C)ccc1C(=O)OCC

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
EGFR P00533 1/20 0.33
TRPV1 Q8NER1 4/20 0.33
ACHE P22303 2/20 0.33
MAOB P27338 2/20 0.32
MAOA P21397 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
SCHEMBL6582338 1.00 MEN1 (0.35) MEN1LMNATP53KMT2AHSD17B10
SCHEMBL6577136 0.87 EGFR (0.32) EGFRTRPV1ACHE
SCHEMBL6577141 0.87 EGFR (0.32) EGFRTRPV1ACHE
SCHEMBL6579851 0.83 TRPV1 (0.36) LMNATP53HSD17B10TRPV1
SCHEMBL6579860 0.83 TRPV1 (0.36) LMNATP53HSD17B10TRPV1
SCHEMBL27523579 0.80 CTSL (0.34) MEN1LMNAKMT2ATRPV1MAOB
SCHEMBL6582265 0.77 TRPV1 (0.35) TRPV1MAOBMAOA
SCHEMBL6582259 0.77 TRPV1 (0.35) TRPV1MAOBMAOA
SCHEMBL6581436 0.76 LMNA (0.44) MEN1LMNATP53KMT2AHSD17B10
SCHEMBL6582042 0.76 KMT2A (0.38) KMT2ATRPV1

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