SCHEMBL3742425

SCHEMBL3742425

N#CC(c1ccnc(OCCN2CCOCC2)n1)c1nc2ccccc2s1

nearest known ligand 0.75

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 11/20 0.75
MAPK9 P45984 10/20 0.75
MAPK8 P45983 2/20 0.75
LTA4H P09960 1/20 0.50
MKNK1 Q9BUB5 2/20 0.45
PIK3CA P42336 2/20 0.44
USP2 O75604 1/20 0.43
GAA P10253 1/20 0.43
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SRC P12931 1/20 0.40

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
SCHEMBL3750843 0.90 MAPK10 (0.66) MAPK10MAPK9MAPK8LTA4HALDH1A1
Bentamapimod SCHEMBL2878382 0.86 MAPK10 (1.00) MAPK10MAPK9MAPK8LTA4HUSP2
Bentamapimod SCHEMBL30197744 0.86 MAPK10 (1.00) MAPK10MAPK9MAPK8LTA4HUSP2
Bentamapimod SCHEMBL29350260 0.86 MAPK10 (1.00) MAPK10MAPK9MAPK8LTA4HUSP2
Bentamapimod SCHEMBL29423429 0.86 MAPK10 (1.00) MAPK10MAPK9MAPK8LTA4HUSP2
SCHEMBL2881959 0.84 MAPK10 (0.64) MAPK10MAPK9MAPK8LTA4HUSP2
SCHEMBL3747858 0.84 MAPK10 (0.86) MAPK10MAPK9MAPK8LTA4HALDH1A1
SCHEMBL4024376 0.83 MAPK10 (0.67) MAPK10MAPK9MAPK8MKNK1USP2
SCHEMBL2878620 0.83 MAPK10 (0.69) MAPK10MAPK9MAPK8MKNK1USP2
Bentamapimod SCHEMBL4948513 0.81 MAPK10 (0.89) MAPK10MAPK9MAPK8LTA4HUSP2

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
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
EP-1812072-A2 BENZOTHIAZOLE FORMULATIONS AND USE THEREOF Ares Trading S.A. (CH) 2007-08-01 EP disclosed
WO-2006053882-A2 BENZOTHIAZOLE FORMULATIONS AND USE THEREOF ARES TRADING S.A. (CH) 2006-05-26 WO 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.