SCHEMBL10903600

SCHEMBL10903600

CC(=O)N(C(C)CC(=O)O)N(C)C

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SLC22A6 Q4U2R8 1/20 0.33
▸ CACNA2D1 P54289 2/20 0.32
▸ CACNB3 P54284 1/20 0.32
▸ CACNA1C Q13936 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ ADRA1A P35348 1/20 0.32
▸ HTR2B P41595 1/20 0.32
▸ CACNA2D2 Q9NY47 1/20 0.32
▸ TDP1 Q9NUW8 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ PHF8 Q9UPP1 1/20 0.31
▸ KDM2A Q9Y2K7 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ BHMT Q93088 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ MAPT P10636 1/20 0.30

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
SCHEMBL10903617 0.81 CACNA2D1 (0.35) SLC22A6CACNA2D1CACNB3CACNA1CPGR
SCHEMBL10906588 0.79 GABRP (0.43) PHF8KDM2A
SCHEMBL10906199 0.78 CHRNB2 (0.33) SLC22A6
SCHEMBL1144278 0.77 SLC22A6 (0.36) SLC22A6CACNA2D1CACNB3CACNA1CPGR
SCHEMBL10905759 0.76 FFAR3 (0.38) ALDH1A1PHF8KDM2AMAPT
SCHEMBL103866 0.74 — —
SCHEMBL105805 0.74 — —
Hydrochloric Acid SCHEMBL4578644 0.72 CHRNB2 (0.40) SLC22A6CACNA2D1CACNB3CACNA1CPGR
SCHEMBL22384141 0.70 SLC22A6 (0.38) SLC22A6CACNA2D1CACNB3CACNA1CPGR
SCHEMBL29953499 0.68 SLC22A6 (0.36) SLC22A6CACNA2D1CACNB3CACNA1CPGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4633014-A ANTIARRHYTHMIA AGENTS INSTITUT ORGANICHESKOGO SINTEZA AKADEMII NAUK LATVIISKOI SSR 1986-12-30 — — US disclosed
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