SCHEMBL15416802

SCHEMBL15416802

c1ccc2c(c1)oc1c2c2ccc3cccc1n32

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM5A P29375 1/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
ALDH1A1 P00352 6/20 0.33
KDM4E B2RXH2 5/20 0.33
HPGD P15428 3/20 0.33
HSD17B10 Q99714 2/20 0.33
GAA P10253 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 1/20 0.33
AHR P35869 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.32
GLA P06280 2/20 0.32
MAPT P10636 2/20 0.32
CYP3A4 P08684 1/20 0.32
PGAM1 P18669 1/20 0.32

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
SCHEMBL15416940 1.00 MAOA (0.35) MAOATDP1L3MBTL1KDM5ANPC1
SCHEMBL19978068 0.82 TDP1 (0.38) MAOATDP1L3MBTL1KDM5ANPC1
SCHEMBL19978066 0.82 L3MBTL1 (0.38) MAOATDP1L3MBTL1KDM5ANPC1
SCHEMBL19978070 0.78 MAOA (0.38) MAOATDP1L3MBTL1KDM5ANPC1
SCHEMBL19978060 0.73 MAOA (0.34) MAOATDP1L3MBTL1KDM5ANPC1
SCHEMBL24117553 0.73 ALOX5 (0.37) MAOAL3MBTL1KDM5AALDH1A1KDM4E
SCHEMBL19978069 0.73 MAOA (0.34) MAOATDP1L3MBTL1KDM5ANPC1
SCHEMBL6251307 0.72 GPR3 (0.44) TDP1L3MBTL1ALDH1A1KDM4EHPGD
SCHEMBL21717878 0.72 ALOX5 (0.39) MAOAL3MBTL1KDM5AALDH1A1KDM4E
SCHEMBL23995597 0.71 MEN1 (0.35) MAOAL3MBTL1KDM5AALDH1A1KDM4E

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013183327-A1 METHOD FOR PRODUCING COMPOUND HAVING CONDENSED RING STRUCTURE, COMPOUND HAVING CONDENSED RING STRUCTURE, AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 国立大学法人奈良先端科学技術大学院大学 (JP) 2013-12-12 WO disclosed