SCHEMBL3887010

SCHEMBL3887010

O=C(CCCCc1ccccc1)CNS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.65
▸ TP53 P04637 1/20 0.65
▸ GAA P10253 1/20 0.65
▸ PRMT1 Q99873 3/20 0.53
▸ TBXA2R P21731 3/20 0.53
▸ PLAAT3 P53816 1/20 0.50
▸ PLAAT5 Q96KN8 1/20 0.50
▸ PLAAT2 Q9NWW9 1/20 0.50
▸ PLAAT4 Q9UL19 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ SGMS1 Q86VZ5 1/20 0.48
▸ MEP1B Q16820 1/20 0.48
▸ CYP19A1 P11511 1/20 0.48
▸ TBXAS1 P24557 1/20 0.47

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
SCHEMBL3892574 0.80 MEP1B (0.54) ALDH1A1MEP1B
SCHEMBL1287271 0.79 ALDH1A1 (1.00) ALDH1A1TP53GAAPRMT1TBXA2R
SCHEMBL9661163 0.78 TBXA2R (0.74) ALDH1A1TP53GAATBXA2RMAPT
SCHEMBL28539623 0.77 L3MBTL1 (0.60) ALDH1A1PRMT1PLAAT3PLAAT5PLAAT2
SCHEMBL27347377 0.77 TBXA2R (0.84) ALDH1A1TP53GAATBXA2RMAPT
SCHEMBL1287281 0.76 PRMT1 (0.83) ALDH1A1TP53GAAPRMT1TBXA2R
SCHEMBL13401886 0.74 ALDH1A1 (0.65) ALDH1A1TP53GAAPRMT1TBXA2R
SCHEMBL10460529 0.74 ALDH1A1 (0.72) ALDH1A1TP53GAATBXA2RMAPT
SCHEMBL5899482 0.74 L3MBTL1 (0.60) ALDH1A1TP53GAAPRMT1TBXA2R
SCHEMBL8789480 0.73 CYP19A1 (0.78) ALDH1A1TP53GAAPRMT1CYP19A1

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
EP-2013184-A1 SULFONAMIDE COMPOUNDS USEFUL AS EDG RECEPTOR MODULATORS AstraZeneca AB (SE) 2009-01-14 — — EP disclosed
WO-2007129019-A1 SULFONAMIDE COMPOUNDS USEFUL AS EDG RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2007-11-15 — — WO disclosed
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