SCHEMBL8545847

SCHEMBL8545847

N#Cc1c(Oc2ccc(CNO)cc2)cccc1Oc1ccc(CNO)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.44
CYP3A4 P08684 1/20 0.41
CACNA1B Q00975 5/20 0.40
THRB P10828 1/20 0.40
IDO1 P14902 1/20 0.40
MAPT P10636 1/20 0.40
HSD11B1 P28845 1/20 0.39
TLR8 Q9NR97 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
CACNA1G O43497 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
CARM1 Q86X55 2/20 0.37
PRMT6 Q96LA8 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CACNA1H O95180 1/20 0.37
BCL2L1 Q07817 1/20 0.36
MCL1 Q07820 1/20 0.36

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
SCHEMBL10752682 0.76 MEN1 (0.48) MAPTHSD11B1TLR8POLBGAA
SCHEMBL8549611 0.76 CYP19A1 (0.49) MAPK14CYP3A4CACNA1BCACNA1GPOLB
SCHEMBL920137 0.74 PARP10 (0.51) THRBIDO1LPAR1LPAR5
SCHEMBL3574617 0.74 KDM4E (0.50) MAPK14CYP3A4MAPTHSD11B1TLR8
SCHEMBL31490388 0.74 KDM4E (0.50) MAPK14CYP3A4MAPTHSD11B1TLR8
Formamide SCHEMBL8545827 0.73 CARM1 (0.48) MAPK14CYP3A4THRBIDO1GAA
SCHEMBL7192577 0.73 NCOA1 (0.49) CYP3A4MAPTHSD11B1TLR8NPC1
SCHEMBL8545423 0.73 SMN1; SMN2 (0.51) THRBIDO1MAPTGAAKDM4E
SCHEMBL12806565 0.73 HSD11B1 (0.40) HSD11B1TLR8NPC1RAB9APOLB
SCHEMBL5936711 0.72 TLR8 (0.46) MAPTTLR8POLBGAAKDM4E

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