SCHEMBL7978004

SCHEMBL7978004

CCCCCCCCOc1c(O)c2cccc(C(=O)O)c2n(C)c1=O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PTPN11 Q06124 4/20 0.43
LTB4R Q15722 2/20 0.42
FABP4 P15090 2/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
TSHR P16473 1/20 0.40

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
SCHEMBL7964612 0.84 ALDH1A1 (0.44) KDM4EALDH1A1HPGDHSD17B10CNR1
SCHEMBL7974970 0.83 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL6576752 0.83 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10CNR1
SCHEMBL6576831 0.83 ALDH1A1 (0.46) KDM4EALDH1A1HPGDHSD17B10PTPN11
SCHEMBL7964550 0.82 TP53 (0.44) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL6579154 0.81 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL27489938 0.81 TSHR (0.56) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL7975932 0.80 ALOX5 (0.42) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6576756 0.80 ESR1 (0.42) KDM4EALDH1A1HPGDHSD17B10CNR1
SCHEMBL7978047 0.79 ALDH1A1 (0.36) KDM4EALDH1A1HPGDHSD17B10CNR1

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