SCHEMBL1786159

SCHEMBL1786159

COC(=O)c1cc(-c2ncccc2N)ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.44
KMT2A Q03164 4/20 0.44
MAPT P10636 4/20 0.44
MEN1 O00255 3/20 0.44
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 3/20 0.44
HSD17B10 Q99714 2/20 0.44
CFTR P13569 2/20 0.44
ABL1 P00519 1/20 0.43
NQO2 P16083 1/20 0.43
TRPV1 Q8NER1 1/20 0.43
GAA P10253 3/20 0.42
HTT P42858 2/20 0.41
NTRK1 P04629 2/20 0.41
ALOX5AP P20292 1/20 0.41
RORB Q92753 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GLA P06280 2/20 0.41
HPGD P15428 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
SCHEMBL15048943 0.84 KDM4E (0.47) KDM4EKMT2AMAPTLMNASMN1; SMN2
SCHEMBL1785348 0.82 LMNA (0.43) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL1787467 0.81 LMNA (0.53) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL1785731 0.81 MEN1 (0.53) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL6718025 0.79 ALDH1A1 (0.52) KDM4EMAPTALDH1A1ABL1TRPV1
SCHEMBL1788339 0.77 P2RX7 (0.58) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL27799366 0.77 DYRK1A (0.58) ALDH1A1HSD17B10GAANPC1
SCHEMBL17186935 0.74 KDM4E (0.43) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL31325681 0.74 ALOX5AP (0.46) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL6718028 0.74 ALDH1A1 (0.58) KDM4EKMT2AMAPTMEN1LMNA

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 KDM4E 1188/4885KMT2A 1721/4885MAPT 3413/4885
US-20120115845-A1 THERAPEUTIC AGENTS GPR119, MC2R, MC4R KDM4E 3215/4885KMT2A 3139/4885MAPT 4086/4885
US-20090186870-A1 Therapeutic Agents - 802 GPR119, SLC5A2, MC2R KDM4E 3524/4885KMT2A 2304/4885MAPT 4300/4885
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R KDM4E 1188/4885KMT2A 1721/4885MAPT 3413/4885

“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.