SCHEMBL1785519

SCHEMBL1785519

COC(=O)c1cc(NN)c(OC)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.58
KDM4E B2RXH2 6/20 0.51
HTT P42858 1/20 0.47
POLB P06746 1/20 0.44
HPGD P15428 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
LMNA P02545 5/20 0.42
ALDH1A1 P00352 4/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 2/20 0.42
HSD17B10 Q99714 1/20 0.42
ABL1 P00519 1/20 0.41
NPSR1 Q6W5P4 2/20 0.41
TSHR P16473 1/20 0.41
TP53 P04637 1/20 0.41
NPY1R P25929 1/20 0.41
NPY2R P49146 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
Hydrochloric Acid SCHEMBL1786171 0.98 GAA (0.56) GAAKDM4EHTTPOLBHPGD
Hydrochloric Acid SCHEMBL1787398 0.86 LRRK2 (0.46) GAAKDM4EHTTPOLBSMN1; SMN2
SCHEMBL1788377 0.85 GAA (0.46) GAAKDM4EHTTHPGDSMN1; SMN2
SCHEMBL1784371 0.85 GAA (0.50) GAAKDM4EHTTHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL27796031 0.84 GAA (0.44) GAAKDM4EHTTHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL1785871 0.84 GAA (0.44) GAAKDM4EHTTHPGDSMN1; SMN2
SCHEMBL16122892 0.83 ALDH1A1 (0.51) GAAKDM4EHTTHPGDSMN1; SMN2
SCHEMBL1785141 0.82 GAA (0.47) GAAKDM4EHTTHPGDSMN1; SMN2
SCHEMBL2476221 0.81 GAA (0.62) GAAKDM4EHTTPOLBHPGD
SCHEMBL5795310 0.81 GAA (0.71) GAAKDM4EHTTPOLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130203730-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2013-08-08 US disclosed
EP-2607357-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS Astrazeneca AB (SE) 2013-06-26 EP disclosed
US-20120115845-A1 THERAPEUTIC AGENTS ALLEN JACK MCQUEEN (GB) 2012-05-10 US disclosed
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2011-05-26 US disclosed
CN-101883762-A Benzothiazoles as modulators of growth hormone releasing hormone receptors ASTRAZENECA AB 2010-11-10 CN disclosed
EP-2205576-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS AstraZeneca AB (SE) 2010-07-14 EP disclosed
US-20090186870-A1 Therapeutic Agents - 802 ASTRAZENECA AB (SE) 2009-07-23 US disclosed
WO-2009047558-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2009-04-16 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 (4 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-20130203730-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R GAA 1879/4885KDM4E 1188/4885HTT 509/4885
US-20120115845-A1 THERAPEUTIC AGENTS GPR119, MC2R, MC4R GAA 402/4885KDM4E 3215/4885HTT 1903/4885
US-20090186870-A1 Therapeutic Agents - 802 GPR119, SLC5A2, MC2R GAA 549/4885KDM4E 3524/4885HTT 2295/4885
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R GAA 1879/4885KDM4E 1188/4885HTT 509/4885

“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.