SCHEMBL15435209

SCHEMBL15435209

COc1ccc(CN2CCc3cc(S(=O)(=O)Nc4ccc(F)cc4)ccc3C2)cc1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MOGAT2 Q3SYC2 10/20 0.63
ABCB1 P08183 4/20 0.58
KMT2A Q03164 2/20 0.54
TNF P01375 1/20 0.50
NOD2 Q9HC29 1/20 0.50
NOD1 Q9Y239 1/20 0.50
ABCC1 P33527 1/20 0.50
ABCG2 Q9UNQ0 1/20 0.50
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
GALR3 O60755 1/20 0.49
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.48
PKM P14618 1/20 0.48
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL15435378 0.91 MOGAT2 (0.61) MOGAT2ABCB1KMT2ATNFNOD2
SCHEMBL15435246 0.91 MOGAT2 (0.77) MOGAT2ABCB1
SCHEMBL15435212 0.89 MOGAT2 (0.61) MOGAT2ABCB1TNFNOD2NOD1
SCHEMBL16715492 0.89 MOGAT2 (0.59) MOGAT2ABCB1KMT2ATNFNOD2
SCHEMBL15435427 0.87 MOGAT2 (0.63) MOGAT2ABCB1KMT2ATNFNOD2
SCHEMBL15435300 0.86 MOGAT2 (0.83) MOGAT2ABCB1
SCHEMBL15435178 0.86 MOGAT2 (0.65) MOGAT2ABCB1KMT2ATNFNOD2
SCHEMBL15435279 0.86 MOGAT2 (0.67) MOGAT2
SCHEMBL15435247 0.85 MOGAT2 (0.69) MOGAT2ABCB1KMT2ATNFNOD2
SCHEMBL15435035 0.83 MOGAT2 (0.63) MOGAT2ABCB1KMT2ATNFNOD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2687507-B1 NITROGEN-CONTAINING CONDENSED HETEROCYCLIC COMPOUND TAISHO PHARMACEUTICAL CO LTD (JP) 2016-03-09 EP disclosed
US-9035059-B2 Nitrogen-containing condensed heterocyclic compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2015-05-19 US disclosed
US-9035059-B2 Nitrogen-containing condensed heterocyclic compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2015-05-19 US disclosed
EP-2687507-A1 NITROGEN-CONTAINING CONDENSED HETEROCYCLIC COMPOUND Taisho Pharmaceutical Co., Ltd. (JP) 2014-01-22 EP disclosed