SCHEMBL29270300

SCHEMBL29270300

Cc1cc(=O)oc2cc(OCCCC(=O)NCCO)ccc12

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ MAOA P21397 2/20 0.57
▸ MAOB P27338 2/20 0.57
▸ KDM4E B2RXH2 5/20 0.56
▸ ALDH1A1 P00352 4/20 0.56
▸ HPGD P15428 2/20 0.56
▸ LMNA P02545 1/20 0.56
▸ HSD17B10 Q99714 1/20 0.56
▸ RXFP1 Q9HBX9 1/20 0.56
▸ MAPT P10636 1/20 0.55
▸ AR P10275 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ RECQL P46063 1/20 0.54
▸ GLA P06280 1/20 0.54
▸ GAA P10253 1/20 0.54

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
SCHEMBL29270309 0.84 MAOA (0.65) KMT2AMEN1MAOAMAOBKDM4E
SCHEMBL6591353 0.84 MAOB (0.70) KMT2AMEN1MAOAMAOBKDM4E
SCHEMBL9204774 0.83 KMT2A (0.66) KMT2AMEN1MAOAMAOBKDM4E
SCHEMBL29677221 0.83 KMT2A (0.66) KMT2AMEN1MAOAMAOBKDM4E
SCHEMBL14199652 0.83 KMT2A (0.71) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL6589340 0.82 MAOB (0.68) KMT2AMEN1MAOAMAOBKDM4E
SCHEMBL6588397 0.81 KMT2A (0.61) KMT2AMEN1MAOAMAOBKDM4E
SCHEMBL17640866 0.80 MAOA (0.57) KMT2AMEN1MAOAMAOBKDM4E
SCHEMBL30593559 0.80 MAOA (0.57) KMT2AMEN1MAOAMAOBKDM4E
SCHEMBL12617458 0.79 MAOB (0.67) KMT2AMEN1MAOAMAOBKDM4E

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
CN-116949592-A Light reversible cross-linked polyester aerogel fiber, preparation method and recovery method thereof 江苏恒科新材料有限公司 2023-10-27 — — CN claimed
CN-116949592-A Light reversible cross-linked polyester aerogel fiber, preparation method and recovery method thereof 江苏恒科新材料有限公司 2023-10-27 — — CN disclosed
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