SCHEMBL3752602

SCHEMBL3752602

CN(C)CCCOc1nccc(C(C#N)c2nc3ccccc3s2)n1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 11/20 0.70
MAPK9 P45984 10/20 0.70
MAPK8 P45983 2/20 0.56
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GFER P55789 1/20 0.39
ATP4A P20648 4/20 0.38
ATP4B P51164 4/20 0.38
MEN1 O00255 2/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
HTT P42858 2/20 0.37
KMT2A Q03164 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
NPY1R P25929 1/20 0.37
NPY2R P49146 1/20 0.37
HTR1A P08908 1/20 0.37
HTR2A P28223 1/20 0.37

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
SCHEMBL3751308 0.95 MAPK10 (0.72) MAPK10MAPK9MAPK8ALDH1A1SMN1; SMN2
SCHEMBL3752829 0.91 MAPK10 (0.67) MAPK10MAPK9MAPK8ALDH1A1SMN1; SMN2
SCHEMBL3746644 0.87 MAPK10 (0.72) MAPK10MAPK9MAPK8ALDH1A1SMN1; SMN2
SCHEMBL4020889 0.84 MAPK10 (0.77) MAPK10MAPK9MAPK8ALDH1A1SMN1; SMN2
SCHEMBL2879293 0.83 MAPK10 (0.67) MAPK10MAPK9MAPK8ALDH1A1SMN1; SMN2
SCHEMBL1518836 0.83 MAPK10 (1.00) MAPK10MAPK9MAPK8ALDH1A1SMN1; SMN2
SCHEMBL1518907 0.81 MAPK10 (1.00) MAPK10MAPK9MAPK8ALDH1A1SMN1; SMN2
SCHEMBL2885027 0.81 MAPK10 (0.76) MAPK10MAPK9MAPK8ALDH1A1SMN1; SMN2
SCHEMBL8360670 0.81 MAPK10 (0.79) MAPK10MAPK9MAPK8ALDH1A1SMN1; SMN2
SCHEMBL4020855 0.81 MAPK10 (0.76) MAPK10MAPK9MAPK8ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7838522-B2 Benzothiazole formulations and use thereof ARES TRADING S.A. (CH) 2010-11-23 US disclosed
US-7838522-B2 Benzothiazole formulations and use thereof ARES TRADING S.A. (CH) 2010-11-23 US disclosed
US-7838522-B2 Benzothiazole formulations and use thereof ARES TRADING S.A. (CH) 2010-11-23 US disclosed
EP-1812072-B1 BENZOTHIAZOLE FORMULATIONS AND USE THEREOF ARES TRADING SA (CH) 2008-10-22 EP disclosed
US-20080051397-A1 Benzothiazole Formulations and Use Thereof ARES TRADING S.A. (CH) 2008-02-28 US disclosed
US-20080051397-A1 Benzothiazole Formulations and Use Thereof ARES TRADING S.A. (CH) 2008-02-28 US disclosed
US-20080051397-A1 Benzothiazole Formulations and Use Thereof ARES TRADING S.A. (CH) 2008-02-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080051397-A1 Benzothiazole Formulations and Use Thereof MGLL, MBOAT4, MBOAT1 MAPK10 3176/4885MAPK9 3960/4885MAPK8 4361/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.