SCHEMBL6581930

SCHEMBL6581930

CCCCCCCCNc1ccc(C(=O)OCC)c(N(C)C(=O)COc2ccc(OC)cc2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.39
ALDH1A1 P00352 5/20 0.39
KDM4E B2RXH2 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MAPK1 P28482 1/20 0.39
TP53 P04637 1/20 0.38
THRB P10828 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
HPGD P15428 4/20 0.38
CA12 O43570 1/20 0.38
CA2 P00918 1/20 0.38
GLA P06280 1/20 0.38
CA3 P07451 1/20 0.38
GAA P10253 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
MAOB P27338 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38

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
SCHEMBL6581961 0.91 LMNA (0.44) MAPTALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL6581270 0.88 KMT2A (0.42) MAPTALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL6582112 0.86 LMNA (0.41) ALDH1A1KDM4ESMN1; SMN2MAPK1THRB
SCHEMBL6579935 0.84 LMNA (0.41) ALDH1A1KDM4ESMN1; SMN2MAPK1TP53
SCHEMBL6579475 0.84 LMNA (0.41) ALDH1A1KDM4ESMN1; SMN2MAPK1TP53
SCHEMBL6579032 0.84 LMNA (0.41) MAPTALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL6579712 0.83 LMNA (0.39) MAPTALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL6581134 0.83 MAPT (0.49) MAPTALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL6579059 0.82 PLK1 (0.39) KDM4EMAPK1CNR1MAOBLMNA
SCHEMBL6581152 0.82 PLK1 (0.39) KDM4EMAPK1CNR1MAOBLMNA

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