SCHEMBL11354810

SCHEMBL11354810

CCOC(=O)c1cc2oc3ccc(C)cc3c(=O)c2nc1N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.60
▸ NPC1 O15118 5/20 0.60
▸ RXFP1 Q9HBX9 3/20 0.60
▸ TBK1 Q9UHD2 4/20 0.53
▸ KDM4E B2RXH2 6/20 0.45
▸ ALDH1A1 P00352 4/20 0.45
▸ GAA P10253 2/20 0.45
▸ GLA P06280 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ HPGD P15428 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ PKM P14618 1/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ MAOB P27338 3/20 0.42
▸ MAOA P21397 1/20 0.42

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
SCHEMBL11361695 0.90 TBK1 (0.60) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL11108156 0.89 MAOB (0.56) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL11356293 0.88 MAOB (0.54) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL11355901 0.88 RAB9A (0.61) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL11358113 0.87 TBK1 (0.53) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL11357263 0.86 TBK1 (0.60) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL2904833 0.85 KDM4E (0.56) RAB9ANPC1TBK1KDM4EALDH1A1
SCHEMBL11367466 0.79 RAB9A (0.49) RAB9ANPC1TBK1KDM4EALDH1A1
SCHEMBL10823671 0.79 RAB9A (0.58) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL11357243 0.78 RAB9A (0.49) RAB9ANPC1RXFP1TBK1KDM4E

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
US-4299963-A ANTIALLERGENS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-11-10 — — US claimed
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