SCHEMBL7141180

SCHEMBL7141180

CCCCCCCCCCCC1=NCCN1.CCCCCCCCCCCCc1ccccc1S(=O)(=O)O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ADRA1A P35348 8/20 0.47
▸ ADRA1D P25100 7/20 0.47
▸ ADRA1B P35368 7/20 0.47
▸ ADRA2C P18825 6/20 0.47
▸ ADRA2A P08913 4/20 0.45
▸ NISCH Q9Y2I1 3/20 0.44
▸ ADRA2B P18089 2/20 0.44
▸ HTR1A P08908 1/20 0.44
▸ TAAR1 Q96RJ0 1/20 0.43
▸ HTR1D P28221 1/20 0.42
▸ MAOA P21397 1/20 0.41
▸ MAOB P27338 1/20 0.41

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
SCHEMBL7141177 1.00 ADRA1A (0.47) ADRA1AADRA1DADRA1BADRA2CADRA2A
SCHEMBL7141308 0.88 ADRA1A (0.47) ADRA1AADRA1DADRA1BADRA2CADRA2A
Hydrochloric Acid SCHEMBL22531231 0.83 LIPG (0.53) —
Hydrochloric Acid SCHEMBL28269600 0.83 LIPG (0.53) —
SCHEMBL8201792 0.83 LIPG (0.53) —
Hydrochloric Acid SCHEMBL5375830 0.82 LIPG (0.51) —
Hydrochloric Acid SCHEMBL5375827 0.82 LIPG (0.51) —
SCHEMBL158973 0.82 LIPG (0.54) —
SCHEMBL6151813 0.82 LIPG (0.54) —
SCHEMBL21121138 0.82 LIPG (0.54) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6521683-B1 Antistatic agents and resin compositions incorporated therein WITCO CORPORATION 2003-02-18 — — US claimed
JP-2002543230-A — — 2002-12-17 — — JP claimed
EP-1177254-A1 ANTISTATIC AGENTS AND RESIN COMPOSITIONS INCORPORATED THEREIN Crompton Corporation (US) 2002-02-06 — — EP claimed
WO-2000064970-A1 ANTISTATIC AGENTS AND RESIN COMPOSITIONS INCORPORATED THEREIN CROMPTON CORPORATION (US) 2000-11-02 — — WO claimed
US-6521683-B1 Antistatic agents and resin compositions incorporated therein WITCO CORPORATION 2003-02-18 — — US disclosed
EP-1177254-A1 ANTISTATIC AGENTS AND RESIN COMPOSITIONS INCORPORATED THEREIN Crompton Corporation (US) 2002-02-06 — — EP disclosed
WO-2000064970-A1 ANTISTATIC AGENTS AND RESIN COMPOSITIONS INCORPORATED THEREIN CROMPTON CORPORATION (US) 2000-11-02 — — WO disclosed
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