SCHEMBL9769115

SCHEMBL9769115

COc1ccc(CCNC(=O)CNc2cccc(C(N)=O)c2)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.56
▸ ALDH1A1 P00352 2/20 0.56
▸ MAPT P10636 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ MEN1 O00255 3/20 0.53
▸ CA12 O43570 1/20 0.52
▸ CA1 P00915 1/20 0.52
▸ CA2 P00918 1/20 0.52
▸ CA9 Q16790 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ ALOX12 P18054 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ NAMPT P43490 1/20 0.52
▸ POLB P06746 1/20 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
Water SCHEMBL9769056 0.99 KMT2A (0.55) KMT2AALDH1A1MAPTHTTMEN1
Hydrochloric Acid SCHEMBL11274170 0.99 KMT2A (0.55) KMT2AALDH1A1MAPTHTTMEN1
SCHEMBL9768959 0.93 CA1 (0.51) KMT2AALDH1A1MAPTHTTMEN1
Water SCHEMBL9768987 0.92 CA1 (0.50) KMT2AALDH1A1MAPTHTTMEN1
SCHEMBL10351021 0.90 POLB (0.58) KMT2AALDH1A1MAPTHTTMEN1
Ecabapide SCHEMBL29367862 0.89 MAPT (0.56) KMT2AALDH1A1MAPTHTTMEN1
Ecabapide SCHEMBL637042 0.89 MAPT (0.56) KMT2AALDH1A1MAPTHTTMEN1
Ecabapide SCHEMBL29367974 0.89 MAPT (0.56) KMT2AALDH1A1MAPTHTTMEN1
Hydrochloric Acid SCHEMBL6370914 0.89 F2 (0.55) KMT2AALDH1A1MAPTHTTMEN1
SCHEMBL9063049 0.89 KMT2A (0.53) KMT2AALDH1A1MAPTHTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0009608-B1 N-PHENETHYLACETAMIDE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC COMPOSITIONS CONTAINING THEM DAIICHI SEIYAKU CO., LTD. (JP) 1982-04-21 — — EP claimed
US-4297357-A ANTIULCER AGENTS; ANTISECRETORY AGENTS DAIICHI SEIYAKU CO., LTD. (JP) 1981-10-27 — — US claimed
EP-0009608-A1 N-Phenethylacetamide compounds, processes for their preparation and therapeutic compositions containing them DAIICHI SEIYAKU CO., LTD. (JP) 1980-04-16 — — EP claimed
US-4985595-A Anti-peptic Ulcer Agents DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1991-01-15 — — US disclosed
EP-0185368-B1 AMINOBENZAMIDE DERIVATIVES DAIICHI SEIYAKU CO., LTD. (JP) 1990-06-06 — — EP disclosed
EP-0185368-A2 Aminobenzamide derivatives DAIICHI SEIYAKU CO., LTD. (JP) 1986-06-25 — — EP disclosed
EP-0009608-B1 N-PHENETHYLACETAMIDE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC COMPOSITIONS CONTAINING THEM DAIICHI SEIYAKU CO., LTD. (JP) 1982-04-21 — — EP disclosed
US-4297357-A ANTIULCER AGENTS; ANTISECRETORY AGENTS DAIICHI SEIYAKU CO., LTD. (JP) 1981-10-27 — — US disclosed
EP-0009608-A1 N-Phenethylacetamide compounds, processes for their preparation and therapeutic compositions containing them DAIICHI SEIYAKU CO., LTD. (JP) 1980-04-16 — — EP disclosed
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