SCHEMBL7671654

SCHEMBL7671654

NCCOCCN(c1ccccc1NCCCOc1ccc(Cl)cc1)S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 1/20 0.38
▸ DRD4 P21917 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ PTGES O14684 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ NR3C1 P04150 1/20 0.36
▸ PGR P06401 1/20 0.36
▸ OXTR P30559 7/20 0.36
▸ AVPR1A P37288 7/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA4 P22748 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ PTGES2 Q9H7Z7 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CYP2C9 P11712 1/20 0.34
▸ MMP2 P08253 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) DRD2DRD4DRD3PTGESMEN1
SCHEMBL7838035 0.94 DRD2 (0.38) DRD2DRD4DRD3PTGESNR3C1
SCHEMBL7667997 0.94 SMN1; SMN2 (0.39) DRD2DRD4DRD3PTGESMEN1
SCHEMBL7667872 0.93 SMN1; SMN2 (0.40) DRD2DRD4DRD3KMT2AALDH1A1
SCHEMBL7671411 0.93 DRD2 (0.39) DRD2DRD4DRD3PTGESMEN1
SCHEMBL7660651 0.93 DRD2 (0.39) DRD2DRD4DRD3PTGESMEN1
SCHEMBL7667975 0.93 ALDH1A1 (0.43) MEN1KMT2AOXTRAVPR1AALDH1A1
SCHEMBL7663075 0.93 DRD4 (0.39) DRD2DRD4DRD3PTGESMEN1
SCHEMBL7663132 0.93 NR3C1 (0.34) DRD2DRD4DRD3PTGESMEN1
Cadaverine Tartrate SCHEMBL7673468 0.90 KEAP1 (0.38) PTGESMEN1KMT2AOXTRAVPR1A

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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