SCHEMBL9648991

SCHEMBL9648991

CCC(Oc1ccc2oc3ccccc3c(=O)c2c1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 3/20 0.59
▸ NPC1 O15118 6/20 0.58
▸ RAB9A P51151 5/20 0.58
▸ POLB P06746 1/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ ACSL1 P33121 4/20 0.57
▸ ACSL6 Q9UKU0 3/20 0.57
▸ TTR P02766 2/20 0.52
▸ ACSL3 O95573 1/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ PPARG P37231 1/20 0.50
▸ PPARA Q07869 1/20 0.50
▸ CASP3 P42574 2/20 0.49
▸ SENP8 Q96LD8 2/20 0.49
▸ SENP7 Q9BQF6 2/20 0.49
▸ SENP6 Q9GZR1 2/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ HPGD P15428 2/20 0.49
▸ MEN1 O00255 2/20 0.49

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
SCHEMBL22730026 0.86 PPARG (0.49) MAOAACSL1ACSL6SMN1; SMN2PPARG
SCHEMBL10868440 0.80 MAOA (0.56) MAOANPC1RAB9APOLBL3MBTL1
SCHEMBL28424879 0.78 MAOA (0.63) MAOANPC1RAB9APOLBL3MBTL1
SCHEMBL29972870 0.78 MAOA (0.63) MAOANPC1RAB9APOLBL3MBTL1
SCHEMBL31193431 0.78 TTR (0.59) MAOANPC1RAB9ATTRSMN1; SMN2
SCHEMBL17304836 0.78 KDM4E (0.59) NPC1RAB9AL3MBTL1SMN1; SMN2PPARG
SCHEMBL9413588 0.77 NPC1 (0.68) MAOANPC1RAB9APOLBL3MBTL1
SCHEMBL30130333 0.77 MAOA (0.70) MAOANPC1RAB9APOLBL3MBTL1
SCHEMBL392389 0.77 MAOA (0.70) MAOANPC1RAB9APOLBL3MBTL1
SCHEMBL11094172 0.77 PPARG (0.62) SMN1; SMN2PPARGPPARA

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-5117009-A XANTHENYLAMIDE HANDLE FOR USE IN PEPTIDE SYNTHESIS UNIVERSITY OF MINNESOTA (US) 1992-05-26 — — US disclosed
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