SCHEMBL1445011

SCHEMBL1445011

O=C(O)C1Cc2ccccc2N1O

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 3/20 0.51

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
SCHEMBL29082762 0.84 AADAT (0.47) ACE
SCHEMBL27867409 0.82 AGTR2 (0.52) ACE
SCHEMBL27867498 0.80 AGTR2 (0.51) —
SCHEMBL29443075 0.80 ACE (0.61) ACE
SCHEMBL5847071 0.80 ACE (0.54) ACE
SCHEMBL8633111 0.80 ACE (0.61) ACE
SCHEMBL5847068 0.80 ACE (0.54) ACE
SCHEMBL10339439 0.80 ACE (0.50) ACE
SCHEMBL4278365 0.80 ACE (0.54) ACE
SCHEMBL17461305 0.80 ACE (0.50) ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102639497-A Compounds inhibitors of enzyme lactate dehydrogenase (LDH) and pharmaceutical compositions containing these compounds UNIV PISA 2012-08-15 — — CN disclosed
EP-2477701-A2 GENTLE DYEING AND LIGHTENING AGENTS HAVING IMPROVED LIGHTENING POWER Henkel AG & Co. KGaA (DE) 2012-07-25 — — EP disclosed
EP-2315614-A1 CATIONIC DIHYDROISOQUINOLINIUM DERIVATIVES FOR USE AS BLEACH ACTIVATORS Henkel AG & Co. KGaA (DE) 2011-05-04 — — EP disclosed
EP-2306967-A1 COLORATION USING CATIONIZABLE POLYMER Henkel AG & Co. KGaA (DE) 2011-04-13 — — EP disclosed
WO-2011032762-A2 GENTLE DYEING AND LIGHTENING AGENTS HAVING IMPROVED LIGHTENING POWER HENKEL AG & CO. KGAA (DE) 2011-03-24 — — WO disclosed
WO-2010066723-A1 HAIR DYE COMPRISING COCOA BUTTER HENKEL AG & CO. KGAA (DE) 2010-06-17 — — WO disclosed
WO-2010022995-A1 CATIONIC DIHYDROISOQUINOLINIUM DERIVATIVES FOR USE AS BLEACH ACTIVATORS HENKEL AG & CO. KGAA (DE) 2010-03-04 — — WO disclosed
WO-2010015442-A1 COLORATION USING CATIONIZABLE POLYMER HENKEL AG & CO. KGAA (DE) 2010-02-11 — — WO disclosed
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