SCHEMBL6582373

SCHEMBL6582373

CCCCCCCCOCC(=O)N(C)c1cc(N(C)C)ccc1C(=O)OCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
TSHR P16473 2/20 0.41
LMNA P02545 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
RAB9A P51151 3/20 0.40
MAPK1 P28482 2/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
KDM4E B2RXH2 2/20 0.38
POLB P06746 1/20 0.38
HSD17B10 Q99714 1/20 0.38
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
NPC1 O15118 2/20 0.37
MAPT P10636 2/20 0.37
HPGD P15428 1/20 0.37
MCL1 Q07820 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL6578896 1.00 ALDH1A1 (0.41) ALDH1A1TSHRLMNAMEN1KMT2A
SCHEMBL6579455 0.95 MEN1 (0.41) ALDH1A1TSHRLMNAMEN1KMT2A
SCHEMBL6579090 0.91 MAOA (0.38) ALDH1A1TSHRLMNARAB9AMAPK1
SCHEMBL6578770 0.91 MEN1 (0.43) ALDH1A1TSHRLMNAMEN1KMT2A
SCHEMBL6579842 0.89 MEN1 (0.45) ALDH1A1TSHRLMNAMEN1KMT2A
SCHEMBL6582006 0.88 CA12 (0.48) ALDH1A1TSHRLMNAMEN1KMT2A
SCHEMBL6582955 0.87 ALDH1A1 (0.44) ALDH1A1TSHRLMNAMEN1KMT2A
SCHEMBL6579314 0.87 ALDH1A1 (0.44) ALDH1A1TSHRLMNAMEN1KMT2A
SCHEMBL6579115 0.86 THRA (0.42) ALDH1A1TSHRLMNAMEN1KMT2A
SCHEMBL6579559 0.83 HPGD (0.42) ALDH1A1TSHRLMNAMEN1KMT2A

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