SCHEMBL1786846

SCHEMBL1786846

CCOc1cc(Cl)c(C(=O)OC)cc1-n1cccn1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 6/20 0.47
HCAR2 Q8TDS4 2/20 0.45
GHSR Q92847 2/20 0.45
HSP90AA1 P07900 1/20 0.38
HSP90B1 P14625 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HCRTR1 O43613 2/20 0.37
HCRTR2 O43614 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.36
THRB P10828 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL1784466 0.88 GHSR (0.42) HCAR1GHSRHCRTR1HCRTR2KDM4E
SCHEMBL1787503 0.87 HCAR1 (0.46) HCAR1HCAR2GHSRHCRTR1HCRTR2
SCHEMBL1785903 0.84 MAPT (0.41) GHSRKDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL1784772 0.84 HSP90AA1 (0.37) HCAR1HCAR2GHSRHSP90AA1HSP90B1
SCHEMBL1784767 0.82 HCAR1 (0.41) HCAR1KDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL1784464 0.81 ACLY (0.42) HCAR1KDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL25046978 0.79 MAPT (0.45) KDM4EALDH1A1LMNATHRB
SCHEMBL3706149 0.77 GHSR (0.41) GHSRTDP1HCRTR1HCRTR2KDM4E
SCHEMBL1785351 0.76 CAPN1 (0.42) GHSRHCRTR1HCRTR2KDM4EALDH1A1
SCHEMBL1787561 0.75 BAZ2B (0.42) HCAR1LMNASMN1; 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-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
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 HCAR1 212/4885HCAR2 301/4885GHSR 2/4885
US-20120115845-A1 THERAPEUTIC AGENTS GPR119, MC2R, MC4R HCAR1 1153/4885HCAR2 1883/4885GHSR 30/4885
US-20090186870-A1 Therapeutic Agents - 802 GPR119, SLC5A2, MC2R HCAR1 961/4885HCAR2 632/4885GHSR 59/4885
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R HCAR1 212/4885HCAR2 301/4885GHSR 2/4885

“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.