SCHEMBL7667997

SCHEMBL7667997

NCCOCCN(c1ccccc1NCCOc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ PGR P06401 2/20 0.39
▸ NR3C1 P04150 1/20 0.39
▸ DRD2 P14416 2/20 0.38
▸ DRD4 P21917 2/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ F2 P00734 3/20 0.36
▸ KEAP1 Q14145 1/20 0.36
▸ NFE2L2 Q16236 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ PTPN22 Q9Y2R2 1/20 0.36
▸ PTGES O14684 1/20 0.35
▸ HTR1A P08908 1/20 0.35
▸ HTR7 P34969 1/20 0.35
▸ MEN1 O00255 1/20 0.34

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
SCHEMBL7671944 0.97 NR3C1 (0.37) SMN1; SMN2NPC1RAB9AMAPTPGR
SCHEMBL7838035 0.96 DRD2 (0.38) SMN1; SMN2NPC1RAB9AMAPTPGR
SCHEMBL7671654 0.94 DRD2 (0.38) SMN1; SMN2PGRNR3C1DRD2DRD4
SCHEMBL7663132 0.93 NR3C1 (0.34) SMN1; SMN2NPC1RAB9AMAPTPGR
SCHEMBL7660651 0.93 DRD2 (0.39) RAB9AMAPTPGRNR3C1DRD2
SCHEMBL7667872 0.93 SMN1; SMN2 (0.40) SMN1; SMN2NPC1MAPTDRD2DRD4
SCHEMBL7671411 0.93 DRD2 (0.39) RAB9AMAPTPGRNR3C1DRD2
SCHEMBL7667975 0.93 ALDH1A1 (0.43) SMN1; SMN2MAPTKEAP1NFE2L2MEN1
SCHEMBL7663075 0.93 DRD4 (0.39) SMN1; SMN2NPC1RAB9AMAPTPGR
Cadaverine Tartrate SCHEMBL7673468 0.92 KEAP1 (0.38) SMN1; SMN2NPC1RAB9AMAPTKEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6403607-B1 ANTIULCER Hidaka, Hiroyoshi (JP) 2002-06-11 — — US disclosed
EP-1072587-A1 SULFONAMIDE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Hidaka, Hiroyoshi (JP) 2001-01-31 — — EP disclosed
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