SCHEMBL9097311

SCHEMBL9097311

Cc1cc2c(c3ccc(=O)[nH]c13)OC(CSCCN(C)C)C2

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 2/20 0.33
▸ NQO2 P16083 1/20 0.31

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 SCHEMBL9096266 0.99 ADRB2 (0.33) ADRB2NQO2
SCHEMBL9097332 0.88 ADRB2 (0.35) ADRB2NQO2
Hydrochloric Acid SCHEMBL9095255 0.87 ADRB2 (0.34) ADRB2NQO2
SCHEMBL9095353 0.83 ADRB2 (0.37) ADRB2NQO2
Hydrochloric Acid SCHEMBL9096171 0.82 METAP1 (0.36) ADRB2NQO2
SCHEMBL9094055 0.79 ADRB2 (0.38) ADRB2NQO2
SCHEMBL9094138 0.79 ADRB2 (0.40) ADRB2NQO2
SCHEMBL9094037 0.79 ADRB2 (0.38) ADRB2NQO2
SCHEMBL9096420 0.79 ADRB2 (0.38) ADRB2NQO2
SCHEMBL9097351 0.79 ADRB2 (0.38) ADRB2NQO2

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-5576324-A Quinoline derivatives or salt thereof and remedy for cardiac diseases containing the same KOWA CO., LTD. (JP) 1996-11-19 — — US disclosed
EP-0638571-A1 QUINOLINE DERIVATIVE OR SALT THEREOF AND REMEDY FOR CARDIAC DISEASES CONTAINING THE SAME KOWA CO. LTD. (JP) 1995-02-15 — — EP disclosed
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