SCHEMBL3745074

SCHEMBL3745074

N#CC(c1ccnc(OCc2ccc(CN3CCc4ccccc4C3)cc2)n1)c1nc2ccccc2s1

nearest known ligand 0.75

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 11/20 0.75
MAPK9 P45984 10/20 0.75
MAPK8 P45983 2/20 0.75
FFAR1 O14842 1/20 0.41
HTR1A P08908 2/20 0.39
HTR2A P28223 2/20 0.39
HTR2C P28335 2/20 0.39
HTR7 P34969 2/20 0.39
HRH1 P35367 1/20 0.39
DRD3 P35462 1/20 0.39
HTR2B P41595 1/20 0.39
DRD2 P14416 1/20 0.39
SLC6A4 P31645 1/20 0.39
GPBAR1 Q8TDU6 1/20 0.39
HDAC1 Q13547 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35

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
SCHEMBL3740598 0.88 MAPK10 (0.85) MAPK10MAPK9MAPK8DRD3DRD2
SCHEMBL3748955 0.88 MAPK10 (0.81) MAPK10MAPK9MAPK8
SCHEMBL4200034 0.88 MAPK10 (0.84) MAPK10MAPK9MAPK8HRH3
Bentamapimod SCHEMBL29350260 0.86 MAPK10 (1.00) MAPK10MAPK9MAPK8
Bentamapimod SCHEMBL2878382 0.86 MAPK10 (1.00) MAPK10MAPK9MAPK8
Bentamapimod SCHEMBL30197744 0.86 MAPK10 (1.00) MAPK10MAPK9MAPK8
Bentamapimod SCHEMBL29423429 0.86 MAPK10 (1.00) MAPK10MAPK9MAPK8
SCHEMBL4198021 0.86 MAPK10 (0.81) MAPK10MAPK9MAPK8
SCHEMBL3746727 0.85 MAPK10 (0.79) MAPK10MAPK9MAPK8
SCHEMBL3322071 0.83 MAPK10 (0.76) MAPK10MAPK9MAPK8HRH3

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.