SCHEMBL8551552

SCHEMBL8551552

O=c1[nH]c(=O)n(Cc2ccc(S(=O)(=O)c3ccc(Cn4oc(=O)[nH]c4=O)cc3)cc2)o1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAT P00750 4/20 0.40
FFAR1 O14842 1/20 0.38
ADRB2 P07550 1/20 0.37
ADRB1 P08588 1/20 0.37
ADRB3 P13945 1/20 0.37
GRM5 P41594 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP3A4 P08684 2/20 0.36
MAPK1 P28482 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
NFKB1 P19838 1/20 0.36
CYP2C19 P33261 1/20 0.36
BLM P54132 1/20 0.36
KMT2A Q03164 1/20 0.36
FOLH1 Q04609 1/20 0.36
GRM1 Q13255 1/20 0.36
GRM3 Q14832 1/20 0.36
HIF1A Q16665 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
SCHEMBL8545723 0.83 FFAR1 (0.41) PLATFFAR1ADRB2ADRB1ADRB3
SCHEMBL2022437 0.80 ALDH1A1 (0.41) PLATFFAR1ADRB2ADRB1ADRB3
SCHEMBL8304003 0.80 DAO (0.50) FFAR1GRM5ALDH1A1CYP3A4MAPK1
SCHEMBL8547639 0.79 FFAR1 (0.39) PLATFFAR1ADRB2ADRB1ADRB3
SCHEMBL8546551 0.79 FFAR1 (0.46) PLATFFAR1GRM5ALDH1A1CYP3A4
SCHEMBL8550945 0.79 FFAR1 (0.46) PLATFFAR1GRM5ALDH1A1CYP3A4
SCHEMBL8549621 0.76 FFAR1 (0.54) PLATFFAR1GRM5ALDH1A1CYP3A4
SCHEMBL8550218 0.76 FFAR1 (0.40) PLATFFAR1ADRB2ADRB1ADRB3
SCHEMBL8551729 0.75 FFAR1 (0.46) PLATFFAR1GRM5ALDH1A1CYP3A4
SCHEMBL8547642 0.75 FFAR1 (0.39) PLATFFAR1ADRB2ADRB1ADRB3

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