SCHEMBL8545870

SCHEMBL8545870

O=Cc1ccc(OCc2cccc(COc3ccc(C=O)cc3)c2)cc1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.71
MAOA P21397 7/20 0.60
MAOB P27338 7/20 0.60
PTPN1 P18031 2/20 0.55
ALDH1A1 P00352 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
PTPRC P08575 1/20 0.54
KDM4E B2RXH2 1/20 0.54
NPC1 O15118 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
LCK P06239 1/20 0.53
F2 P00734 2/20 0.51
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
HPGD P15428 1/20 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
SCHEMBL27983208 0.90 RAB9A (0.63) RAB9AMAOAMAOBPTPN1ALDH1A1
SCHEMBL13220846 0.89 MAOB (0.76) RAB9AMAOAMAOBPTPN1NPC1
SCHEMBL30399352 0.89 MAOB (0.65) RAB9AMAOAMAOB
SCHEMBL1347334 0.89 MAOB (0.76) RAB9AMAOAMAOB
SCHEMBL30398583 0.89 MAOB (0.76) RAB9AMAOAMAOBALDH1A1SMN1; SMN2
SCHEMBL1164139 0.89 MAOB (0.74) RAB9AMAOAMAOBALDH1A1KDM4E
SCHEMBL3423658 0.89 MAOB (0.65) RAB9AMAOAMAOB
SCHEMBL2019824 0.89 MAOB (0.76) RAB9AMAOAMAOBALDH1A1SMN1; SMN2
SCHEMBL29464145 0.89 MAOB (0.76) RAB9AMAOAMAOB
SCHEMBL7958497 0.87 RAB9A (0.64) RAB9AMAOAMAOBLCKF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0696585-B1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMA CO LTD (JP) 1998-12-16 EP disclosed
US-5643931-A ANTIDIABETIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 US disclosed
EP-0696585-A1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-02-14 EP disclosed