SCHEMBL9063062

SCHEMBL9063062

CCNC(=O)c1cccc(NCC(=O)NCCc2ccc(OC)c(OC)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.54
▸ MAPT P10636 3/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ HTT P42858 1/20 0.53
▸ POLB P06746 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ MEN1 O00255 1/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ ALOX12 P18054 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ NAMPT P43490 1/20 0.52

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
SCHEMBL9063229 0.91 MAPK1 (0.56) MAPK1MAPTKMT2AALDH1A1HTT
Ecabapide SCHEMBL29367974 0.91 MAPT (0.56) MAPK1MAPTKMT2AALDH1A1HTT
Ecabapide SCHEMBL29367862 0.91 MAPT (0.56) MAPK1MAPTKMT2AALDH1A1HTT
Ecabapide SCHEMBL637042 0.91 MAPT (0.56) MAPK1MAPTKMT2AALDH1A1HTT
SCHEMBL9769115 0.89 KMT2A (0.56) MAPK1MAPTKMT2AALDH1A1HTT
Hydrochloric Acid SCHEMBL11274170 0.88 KMT2A (0.55) MAPK1MAPTKMT2AALDH1A1HTT
Water SCHEMBL9769056 0.88 KMT2A (0.55) MAPK1MAPTKMT2AALDH1A1HTT
SCHEMBL9063049 0.86 KMT2A (0.53) MAPK1MAPTKMT2AALDH1A1HTT
Hydrochloric Acid SCHEMBL6370914 0.84 F2 (0.55) MAPK1MAPTKMT2AALDH1A1HTT
SCHEMBL11282670 0.84 ERCC1 (0.65) MAPTKMT2AALDH1A1HTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0185368-B1 AMINOBENZAMIDE DERIVATIVES DAIICHI SEIYAKU CO., LTD. (JP) 1990-06-06 — — EP claimed
EP-0185368-A2 Aminobenzamide derivatives DAIICHI SEIYAKU CO., LTD. (JP) 1986-06-25 — — EP claimed
EP-0697215-A1 DIGESTIVE SYMPTOM AMELIORANT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1996-02-21 — — EP disclosed
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
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