SCHEMBL10952598

SCHEMBL10952598

Cc1nc(N(C)C)sc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.63
▸ ALDH1A1 P00352 6/20 0.63
▸ MAPK1 P28482 3/20 0.63
▸ LMNA P02545 3/20 0.63
▸ TDP1 Q9NUW8 2/20 0.63
▸ NPSR1 Q6W5P4 1/20 0.63
▸ VCAM1 P19320 2/20 0.56
▸ RAF1 P04049 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ GFER P55789 1/20 0.52
▸ PAX8 Q06710 1/20 0.52
▸ F2 P00734 1/20 0.50
▸ HTT P42858 2/20 0.46
▸ GAA P10253 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ KMT2A Q03164 2/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ MEN1 O00255 1/20 0.42

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
SCHEMBL10955595 0.86 MAPT (0.48) MAPTALDH1A1MAPK1LMNATDP1
SCHEMBL10955062 0.82 MAPT (0.63) MAPTALDH1A1MAPK1LMNATDP1
SCHEMBL11006729 0.79 LMNA (0.60) MAPTALDH1A1MAPK1LMNATDP1
SCHEMBL10955470 0.78 MAPT (0.98) MAPTALDH1A1MAPK1LMNATDP1
SCHEMBL11159298 0.78 MAPT (0.63) MAPTALDH1A1MAPK1LMNATDP1
SCHEMBL10957665 0.77 MAPT (0.57) MAPTALDH1A1MAPK1LMNATDP1
SCHEMBL11158198 0.76 ALDH1A1 (0.56) MAPTALDH1A1MAPK1LMNATDP1
SCHEMBL10958069 0.76 MAPT (0.56) MAPTALDH1A1MAPK1LMNATDP1
SCHEMBL10954761 0.75 ALDH1A1 (0.55) MAPTALDH1A1MAPK1LMNATDP1
SCHEMBL1258621 0.74 VCAM1 (1.00) MAPTALDH1A1MAPK1LMNAVCAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0008047-B1 5(6)-(2-AMINO-5-THIAZOLOYL)BENZIMIDAZOLE-2-CARBAMIC ACID ESTERS AND THEIR SALTS, THEIR PREPARATION AND USE, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CIBA-GEIGY AG (CH) 1985-12-04 — — EP disclosed
US-4386097-A Benzimidazoles, processes for their preparation and pharmaceutical preparations containing such compounds CIBA-GEIGY CORPORATION (US) 1983-05-31 — — US disclosed
US-4297365-A Benzimidazoles and pharmaceutical preparations containing such compounds CIBA-GEIGY CORPORATION (US) 1981-10-27 — — US disclosed
EP-0008047-A1 5(6)-(2-Amino-5-thiazoloyl)benzimidazole-2-carbamic acid esters and their salts, their preparation and use, and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1980-02-20 — — EP disclosed
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