SCHEMBL8995916

SCHEMBL8995916

Cc1ccc2oc(-c3ccc(N)cc3)cc2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.71
APP P05067 4/20 0.66
ESR1 P03372 1/20 0.50
ESR2 Q92731 1/20 0.50
MAOA P21397 1/20 0.50
EGFR P00533 1/20 0.49
SRC P12931 1/20 0.49
ADORA3 P0DMS8 1/20 0.49
F12 P00748 1/20 0.47
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
NFKB1 P19838 1/20 0.46
RAB9A P51151 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL9947483 0.90 MAOB (0.61) MAOBAPPESR1ESR2EGFR
SCHEMBL11850978 0.89 MAOB (0.80) MAOBAPPESR1ESR2MAOA
SCHEMBL28751161 0.86 MAOB (0.53) MAOBAPPEGFRSRCKDM4E
SCHEMBL7818265 0.85 APP (0.74) MAOBAPPESR1ESR2EGFR
SCHEMBL735803 0.83 MAOB (0.71) MAOBAPPESR1ESR2MAOA
SCHEMBL9947476 0.83 MAOB (0.71) MAOBAPPESR1ESR2MAOA
SCHEMBL3983367 0.82 MAOB (1.00) MAOBESR1ESR2MAOAADORA3
SCHEMBL7117044 0.81 MAOB (0.69) MAOBAPPESR1ESR2MAOA
SCHEMBL14900924 0.81 APP (0.68) MAOBAPPESR1ESR2EGFR
SCHEMBL14231743 0.81 MAOB (0.71) MAOBMAOAADORA3ALDH1A1

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
CN-1410422-A Benzfuran compound SHARP KK (JP) 2003-04-16 CN disclosed
EP-0527704-B1 Dyestuffs, process for their preparation and the use thereof CIBA GEIGY AG (CH) 1996-08-28 EP disclosed
US-5302704-A For dyeing polyamide fibers; colorfastness CIBA-GEIGY CORPORATION (US) 1994-04-12 US disclosed
EP-0527704-A2 Dyestuffs, process for their preparation and the use thereof CIBA-GEIGY AG (CH) 1993-02-17 EP disclosed