SCHEMBL15435191

SCHEMBL15435191

O=S(=O)(Nc1ccc(F)cc1)c1ccc2c(c1)CCN(CCc1ccc(-c3ccccc3)cc1)C2

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MOGAT2 Q3SYC2 16/20 0.75
ABCB1 P08183 2/20 0.53
MGAT2 Q10469 1/20 0.49
MLNR O43193 1/20 0.48
DRD2 P14416 1/20 0.48
DRD3 P35462 1/20 0.48
HTR6 P50406 1/20 0.48
GHSR Q92847 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
SCHEMBL16715481 0.90 MOGAT2 (0.68) MOGAT2ABCB1
SCHEMBL15435261 0.89 MOGAT2 (0.81) MOGAT2
SCHEMBL15435356 0.89 MOGAT2 (0.78) MOGAT2DRD2DRD3HTR6
SCHEMBL15399493 0.87 MOGAT2 (0.84) MOGAT2
SCHEMBL15399787 0.86 MOGAT2 (1.00) MOGAT2
SCHEMBL16715479 0.86 MOGAT2 (0.77) MOGAT2
SCHEMBL15435246 0.86 MOGAT2 (0.77) MOGAT2ABCB1
SCHEMBL15435172 0.85 MOGAT2 (0.56) MOGAT2ABCB1MLNRDRD2DRD3
SCHEMBL16715478 0.84 MOGAT2 (0.75) MOGAT2
SCHEMBL15435427 0.84 MOGAT2 (0.63) MOGAT2ABCB1MGAT2HTR6

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