SCHEMBL793263

SCHEMBL793263

OCc1csc(-c2c(Cl)cccc2Cl)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NUDT1 P36639 1/20 0.41
GFER P55789 1/20 0.40
NOTUM Q6P988 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
SCD O00767 1/20 0.38
POLB P06746 1/20 0.38
SRC P12931 1/20 0.36
CDK2 P24941 1/20 0.36
ZAP70 P43403 1/20 0.36
SYK P43405 1/20 0.36
SHMT1 P34896 2/20 0.36
SHMT2 P34897 2/20 0.36
KDM4E B2RXH2 1/20 0.36
TYK2 P29597 2/20 0.36
SCN9A Q15858 1/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36

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
SCHEMBL792431 0.89 SMN1; SMN2 (0.45) ALDH1A1TDP1L3MBTL1NUDT1GFER
SCHEMBL5895082 0.83 ALDH1A1 (0.73) ALDH1A1TDP1L3MBTL1NUDT1NOTUM
SCHEMBL3373139 0.76 LMNA (0.56) ALDH1A1TDP1L3MBTL1GFERSMN1; SMN2
SCHEMBL1177423 0.74 GFER (0.72) ALDH1A1TDP1GFERNOTUMSMN1; SMN2
SCHEMBL20255674 0.73 SHMT2 (0.69) ALDH1A1SMN1; SMN2SHMT1SHMT2KDM4E
SCHEMBL9028719 0.73 EIF4E (0.49) ALDH1A1TDP1GFERSHMT1SHMT2
SCHEMBL5216053 0.73 CDK5 (0.49) ALDH1A1TDP1L3MBTL1SCDCDK2
SCHEMBL15640894 0.73 PDE10A (0.47) ALDH1A1TDP1L3MBTL1SMN1; SMN2POLB
SCHEMBL104951 0.73 KDM4E (0.58) ALDH1A1L3MBTL1SMN1; SMN2KDM4EDRD2
SCHEMBL25410319 0.71 KDM4E (0.55) ALDH1A1TDP1L3MBTL1SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023170024-A1 CAMK2 MODULATORS AND THEIR USE IN MEDICINE UNIVERSITY OF COPENHAGEN (DK) 2023-09-14 WO disclosed
US-20140171408-A1 AZABENZOTHIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2014-06-19 US disclosed
US-8697708-B2 Azabenzothiazole compounds, compositions and methods of use F. HOFFMANN-LA ROCHE AG (CH) 2014-04-15 US disclosed
EP-2616072-A1 AZABENZOTHIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F.HOFFMANN-LA ROCHE AG (CH) 2013-07-24 EP disclosed
US-20120202788-A1 AZABENZOTHIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2012-08-09 US disclosed
WO-2012035039-A1 AZABENZOTHIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2012-03-22 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 (2 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-20140171408-A1 AZABENZOTHIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F12, CHRM1, NPY1R ALDH1A1 1372/4885TDP1 364/4885L3MBTL1 3602/4885
US-20120202788-A1 AZABENZOTHIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F12, CHRM1, NPY1R ALDH1A1 1372/4885TDP1 364/4885L3MBTL1 3602/4885

“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.