SCHEMBL7010764

SCHEMBL7010764

COc1cc(Nc2ccc3c(c2)OCO3)cc(OC)c1OC

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.59
LMNA P02545 1/20 0.56
NPC1 O15118 4/20 0.53
RAB9A P51151 3/20 0.53
NQO1 P15559 1/20 0.51
MAPT P10636 3/20 0.50
TP53 P04637 2/20 0.50
ALDH1A1 P00352 2/20 0.50
EPHB4 P54760 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
PKM P14618 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MAPK1 P28482 1/20 0.50
TSHR P16473 1/20 0.50
USP2 O75604 1/20 0.50
HSP90AA1 P07900 1/20 0.50
HSP90AB1 P08238 1/20 0.50
STK10 O94804 1/20 0.50
SLK Q9H2G2 1/20 0.50
PTGS2 P35354 1/20 0.49

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
SCHEMBL6976166 0.82 EPHB4 (0.69) LMNAEPHB4SLK
SCHEMBL378949 0.80 SMN1; SMN2 (0.62) LMNANPC1RAB9AMAPTALDH1A1
SCHEMBL1920755 0.78 NPC1 (0.60) LMNANPC1RAB9AMAPTALDH1A1
SCHEMBL9709093 0.77 ALDH1A1 (0.67) PDE5ALMNAMAPTALDH1A1TDP1
SCHEMBL2773934 0.77 LMNA (0.57) PDE5ALMNANPC1RAB9AMAPT
SCHEMBL7052008 0.75 NPC1 (0.51) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL7498159 0.75 PDE5A (1.00) PDE5ANPC1RAB9AMAPTSMN1; SMN2
SCHEMBL6981394 0.74 CLK1 (0.69) ALDH1A1EPHB4
SCHEMBL743802 0.73 MAPT (0.59) PDE5ALMNANPC1RAB9AMAPT
SCHEMBL1921386 0.73 CLK1 (0.55) LMNANPC1RAB9AMAPTALDH1A1

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-1103554-B9 Derivatives of dihydrofuro-(3,4-b)-quinolein-1-ones, process of préparation and phamaceutical compositions containing them SERVIER LAB (FR) 2003-12-17 EP disclosed
US-6548515-B1 Use as anticancer agents LES LABORATORIES SERVIER (FR) 2003-04-15 US disclosed
EP-1103554-B1 Derivatives of dihydrofuro-(3,4-b)-quinolein-1-ones, process of préparation and phamaceutical compositions containing them SERVIER LAB (FR) 2003-03-12 EP disclosed
EP-1103554-A1 Derivatives of dihydrofuro-(3,4-b)-quinolein-1-ones, process of préparation and phamaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2001-05-30 EP disclosed