SCHEMBL1786323

SCHEMBL1786323

COC(=O)c1cc(N)c(OC(C)C)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.51
ABL1 P00519 1/20 0.46
KDM4E B2RXH2 6/20 0.45
ALDH1A1 P00352 5/20 0.44
HSD17B10 Q99714 3/20 0.44
CFTR P13569 1/20 0.44
HTT P42858 1/20 0.42
RORC P51449 1/20 0.41
ULK1 O75385 1/20 0.41
GLA P06280 2/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 2/20 0.41
IRAK4 Q9NWZ3 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
ATM Q13315 1/20 0.41
NQO2 P16083 4/20 0.40
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL24717996 0.87 KDM4E (0.54) GAAABL1KDM4EALDH1A1HSD17B10
SCHEMBL30798548 0.87 KDM4E (0.54) GAAABL1KDM4EALDH1A1HSD17B10
SCHEMBL15048858 0.84 ALDH1A1 (0.44) GAAALDH1A1RORCMAPTHPGD
SCHEMBL1787264 0.84 GAA (0.66) GAAABL1KDM4EALDH1A1HSD17B10
SCHEMBL1788377 0.82 GAA (0.46) GAAABL1KDM4EALDH1A1HSD17B10
SCHEMBL29152465 0.82 KDM4E (0.49) GAAABL1KDM4EALDH1A1HSD17B10
SCHEMBL19554257 0.82 GAA (0.59) GAAABL1KDM4EALDH1A1HSD17B10
SCHEMBL22987085 0.82 GAA (0.72) GAAABL1KDM4EALDH1A1HTT
Hydrochloric Acid SCHEMBL27796031 0.81 GAA (0.44) GAAABL1KDM4EALDH1A1HSD17B10
SCHEMBL9793695 0.80 GAA (0.59) GAAABL1KDM4EALDH1A1HSD17B10

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 1879/4885ABL1 1364/4885KDM4E 1188/4885
US-20120115845-A1 THERAPEUTIC AGENTS GPR119, MC2R, MC4R GAA 402/4885ABL1 898/4885KDM4E 3215/4885
US-20090186870-A1 Therapeutic Agents - 802 GPR119, SLC5A2, MC2R GAA 549/4885ABL1 983/4885KDM4E 3524/4885
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R GAA 1879/4885ABL1 1364/4885KDM4E 1188/4885

“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.