SCHEMBL1788949

SCHEMBL1788949

CC(C)Oc1cc(Cl)c(C(N)=O)cc1-n1cccn1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 9/20 0.45
MKNK1 Q9BUB5 2/20 0.40
MKNK2 Q9HBH9 2/20 0.40
KCNH2 Q12809 4/20 0.39
CAPN1 P07384 1/20 0.38
PTGDR Q13258 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
G6PD P11413 1/20 0.36
KMT2A Q03164 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
SCHEMBL3702097 0.89 PTGDR (0.39) IRAK4KCNH2PTGDRKDM4EMEN1
SCHEMBL1784772 0.87 HSP90AA1 (0.37) PTGDRKDM4EMEN1ALDH1A1LMNA
SCHEMBL1785351 0.86 CAPN1 (0.42) IRAK4MKNK1MKNK2CAPN1KDM4E
SCHEMBL1787503 0.83 HCAR1 (0.46) MKNK1MKNK2KCNH2CAPN1KDM4E
SCHEMBL1786708 0.81 CAPN1 (0.47) IRAK4MKNK1MKNK2CAPN1KDM4E
SCHEMBL1789180 0.80 CAPN1 (0.42) MKNK1MKNK2CAPN1KDM4EMEN1
SCHEMBL1783427 0.77 CAPN1 (0.42) MKNK1MKNK2KCNH2CAPN1KDM4E
SCHEMBL3706149 0.75 GHSR (0.41) IRAK4KCNH2KDM4EMEN1ALDH1A1
SCHEMBL1784466 0.74 GHSR (0.42) IRAK4KDM4EMEN1ALDH1A1LMNA
SCHEMBL1786846 0.71 HCAR1 (0.47) KDM4EALDH1A1LMNA

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 IRAK4 791/4885MKNK1 2854/4885MKNK2 3011/4885
US-20120115845-A1 THERAPEUTIC AGENTS GPR119, MC2R, MC4R IRAK4 843/4885MKNK1 3289/4885MKNK2 3314/4885
US-20090186870-A1 Therapeutic Agents - 802 GPR119, SLC5A2, MC2R IRAK4 990/4885MKNK1 2805/4885MKNK2 2108/4885
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R IRAK4 791/4885MKNK1 2854/4885MKNK2 3011/4885

“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.