SCHEMBL11635287

SCHEMBL11635287

NC(=O)COc1coc2ccccc2c1=O

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.57
▸ MEN1 O00255 2/20 0.57
▸ HSD17B10 Q99714 2/20 0.54
▸ ALDH1A1 P00352 3/20 0.52
▸ PKM P14618 1/20 0.52
▸ MAOB P27338 11/20 0.50
▸ HTT P42858 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ MAOA P21397 3/20 0.43
▸ PTPN1 P18031 1/20 0.43
▸ ADORA2B P29275 2/20 0.43
▸ POLB P06746 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HPGD P15428 1/20 0.41

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
SCHEMBL11636817 0.87 KDM4E (0.55) KMT2AMEN1ALDH1A1MAOBKDM4E
SCHEMBL9390486 0.76 MAOB (0.49) KMT2AMEN1HSD17B10ALDH1A1MAOB
SCHEMBL29180246 0.76 MAOB (0.49) KMT2AMEN1HSD17B10ALDH1A1MAOB
SCHEMBL30558218 0.76 MAOB (0.50) MAOBMAOAPTPN1
SCHEMBL6203939 0.75 MAOB (0.63) MAOBMAOAPTPN1ADORA2B
SCHEMBL11636931 0.75 MAOB (0.47) KMT2AMEN1HSD17B10ALDH1A1MAOB
SCHEMBL11668249 0.74 MAOB (0.57) KMT2AMEN1ALDH1A1MAOBHTT
SCHEMBL30558227 0.73 MAOB (0.48) MAOBMAOAPTPN1
SCHEMBL30963746 0.73 MAOB (0.56) KMT2AMEN1HSD17B10ALDH1A1MAOB
SCHEMBL17943730 0.73 MAOB (0.56) KMT2AMEN1HSD17B10ALDH1A1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4127669-A [(4-Oxo-4H-1-benzopyran-3-yl)oxy] acetic acids and derivatives WARNER-LAMBERT COMPANY (US) 1978-11-28 — — US claimed
US-4127669-A [(4-Oxo-4H-1-benzopyran-3-yl)oxy] acetic acids and derivatives WARNER-LAMBERT COMPANY (US) 1978-11-28 — — US disclosed
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