SCHEMBL7663066

SCHEMBL7663066

CN(C)CCN(c1ccccc1NCCOc1ccc(Cl)cc1)S(=O)(=O)c1cccc(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 3/20 0.41
▸ F2 P00734 3/20 0.39
▸ MAPT P10636 3/20 0.38
▸ LMNA P02545 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ OXTR P30559 2/20 0.38
▸ AVPR1A P37288 2/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.38
▸ ALPG P10696 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ CACNA1H O95180 1/20 0.37
▸ CACNA1B Q00975 1/20 0.37

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
Hydrochloric Acid SCHEMBL7663056 0.99 PGR (0.40) PGRF2MAPTLMNAKDM4E
Hydrochloric Acid SCHEMBL7670137 0.91 OXTR (0.41) PGRF2MAPTTP53THRB
SCHEMBL7672815 0.91 OXTR (0.42) PGRMAPTLMNAOXTRAVPR1A
SCHEMBL7674901 0.91 KDM4E (0.45) F2MAPTKDM4EALPGSMN1; SMN2
Hydrochloric Acid SCHEMBL7674892 0.90 KDM4E (0.44) F2MAPTKDM4EALPGSMN1; SMN2
SCHEMBL7671754 0.88 NPC1 (0.43) PGRF2MAPTOXTRAVPR1A
SCHEMBL7670754 0.88 SMN1; SMN2 (0.42) F2MAPTTP53OXTRAVPR1A
SCHEMBL7665766 0.88 ALDH1A1 (0.46) MAPTLMNATP53OXTRAVPR1A
Hydrochloric Acid SCHEMBL7671744 0.87 NPC1 (0.43) PGRF2MAPTOXTRAVPR1A
Phosphoric Acid SCHEMBL7665536 0.87 OXTR (0.41) OXTRAVPR1AHRH3SMN1; SMN2CACNA1H

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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