SCHEMBL1551583

SCHEMBL1551583

CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.57
MAPT P10636 4/20 0.54
ALDH1A1 P00352 2/20 0.54
MAPK1 P28482 2/20 0.54
NPSR1 Q6W5P4 2/20 0.52
KDM4E B2RXH2 2/20 0.52
TSHR P16473 1/20 0.51
HSD17B10 Q99714 1/20 0.51
PKM P14618 1/20 0.51
HTT P42858 2/20 0.51
IDH1 O75874 1/20 0.51
LMNA P02545 1/20 0.51
APP P05067 1/20 0.49
PHGDH O43175 1/20 0.49

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
Nitrogen SCHEMBL27371697 0.97 PDE7A (0.61) PDE7AL3MBTL1MAPTALDH1A1MAPK1
SCHEMBL10712446 0.87 MAPT (0.64) PDE7AL3MBTL1MAPTALDH1A1MAPK1
SCHEMBL14656523 0.86 ALDH3A1 (0.58) PDE7AL3MBTL1MAPTALDH1A1MAPK1
SCHEMBL26125825 0.85 ALDH1A1 (0.56) PDE7AL3MBTL1MAPTALDH1A1MAPK1
SCHEMBL10853042 0.84 PDE7A (0.51) PDE7AL3MBTL1MAPTALDH1A1MAPK1
SCHEMBL3840810 0.84 MAPT (0.54) PDE7AL3MBTL1MAPTALDH1A1MAPK1
SCHEMBL11455085 0.84 PDE7A (0.54) PDE7AL3MBTL1MAPTMAPK1NPSR1
SCHEMBL4129918 0.83 L3MBTL1 (0.54) PDE7AL3MBTL1MAPTALDH1A1MAPK1
SCHEMBL5705175 0.83 L3MBTL1 (0.67) L3MBTL1MAPTALDH1A1MAPK1NPSR1
SCHEMBL11017748 0.82 TDP1 (0.67) PDE7AL3MBTL1MAPTALDH1A1MAPK1

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 59 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103601684-B 5-arylseleno benzimidazoles compound and uses thereof SHENYANG PHARMACEUTICAL UNIVERSITY (CN) 2016-01-20 CN claimed
EP-1590332-B1 A PROCESS FOR THE SYNTHESIS OF BISBENZIMIDAZOLES AND THEIR DERIVATIVES. UNIV DELHI (IN) 2011-04-27 EP claimed
EP-1590332-A1 A PROCESS FOR THE SYNTHESIS OF BISBENZIMIDAZOLES AND ITS DERIVATIONS University of Delhi (IN) 2005-11-02 EP claimed
WO-2004063170-A1 A PROCESS FOR THE SYNTHESIS OF BISBENZIMIDAZOLES AND ITS DERIVATIONS UNIVERSITY OF DELHI (IN) 2004-07-29 WO claimed
CN-103601684-B 5-arylseleno benzimidazoles compound and uses thereof SHENYANG PHARMACEUTICAL UNIVERSITY (CN) 2016-01-20 CN disclosed
CN-103601684-A 5-arylselenobenzimidazole compound and application thereof UNIV SHENYANG PHARMACEUTICAL 2014-02-26 CN disclosed
EP-1590332-B1 A PROCESS FOR THE SYNTHESIS OF BISBENZIMIDAZOLES AND THEIR DERIVATIVES. UNIV DELHI (IN) 2011-04-27 EP disclosed
EP-1590332-B1 A PROCESS FOR THE SYNTHESIS OF BISBENZIMIDAZOLES AND THEIR DERIVATIVES. UNIV DELHI (IN) 2011-04-27 EP disclosed
WO-2010126922-A1 BENZIMIDAZOLECARBOXAMIDES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC (US) 2010-11-04 WO disclosed
WO-2010126922-A1 BENZIMIDAZOLECARBOXAMIDES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC (US) 2010-11-04 WO disclosed
EP-1590332-A1 A PROCESS FOR THE SYNTHESIS OF BISBENZIMIDAZOLES AND ITS DERIVATIONS University of Delhi (IN) 2005-11-02 EP disclosed
EP-1590332-A1 A PROCESS FOR THE SYNTHESIS OF BISBENZIMIDAZOLES AND ITS DERIVATIONS University of Delhi (IN) 2005-11-02 EP disclosed
US-4011320-A PESTICIDES, FUNGICIDES SYNTEX (U.S.A.) INC. (US) 1977-03-08 US disclosed
US-4005202-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1977-01-25 US disclosed
US-4002640-A ANTIFUNGAL AGENTS SYNTEX (U.S.A.) INC. (US) 1977-01-11 US disclosed
US-3969526-A Anthelmintic 5-heterocycliothio and oxy-2-carbalkoxyaminobenzimidazles SMITHKLINE CORPORATION (US) 1976-07-13 US disclosed
US-3965113-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1976-06-22 US disclosed
US-3962437-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1976-06-08 US disclosed
US-3956499-A ANTHELMINTICS SMITHKLINE CORPORATION (US) 1976-05-11 US disclosed
US-3935209-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1976-01-27 US disclosed