SCHEMBL1785425

SCHEMBL1785425

CS(=O)(=O)c1ccc2nc(NC(=O)NC(=O)c3cc(OC4CCNCC4)ccc3Cl)sc2c1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 14/20 0.64
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
HPGD P15428 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
CHRNA4 P43681 1/20 0.52
SLC6A3 Q01959 1/20 0.52
HCAR1 Q9BXC0 1/20 0.51
KDM4E B2RXH2 2/20 0.50
RECQL P46063 1/20 0.50
RXFP1 Q9HBX9 2/20 0.49
HSD17B10 Q99714 1/20 0.49
ALDH1A1 P00352 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
POLB P06746 1/20 0.49

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
SCHEMBL1785514 0.95 GHSR (0.62) GHSRKMT2AMEN1HPGDSMN1; SMN2
SCHEMBL1785399 0.93 GHSR (0.67) GHSRKMT2AMEN1HPGDSMN1; SMN2
SCHEMBL1788643 0.92 GHSR (0.66) GHSRKMT2AMEN1HPGDSMN1; SMN2
SCHEMBL1788864 0.90 GHSR (0.65) GHSRCHRNA4SLC6A3HCAR1
SCHEMBL1787721 0.89 GHSR (0.66) GHSRKMT2AMEN1HPGDSMN1; SMN2
SCHEMBL2679755 0.89 GHSR (0.62) GHSRKMT2AMEN1HPGDSMN1; SMN2
SCHEMBL1784972 0.88 GHSR (0.63) GHSRCHRNA4SLC6A3HCAR1
SCHEMBL2679282 0.88 GHSR (0.64) GHSRKMT2AMEN1HPGDSMN1; SMN2
SCHEMBL1789901 0.87 GHSR (0.63) GHSRKMT2AMEN1HPGDSMN1; SMN2
SCHEMBL1787370 0.86 GHSR (0.60) GHSRKMT2AMEN1HPGDSMN1; 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 GHSR 2/4885KMT2A 1721/4885MEN1 2250/4885
US-20120115845-A1 THERAPEUTIC AGENTS GPR119, MC2R, MC4R GHSR 30/4885KMT2A 3139/4885MEN1 692/4885
US-20090186870-A1 Therapeutic Agents - 802 GPR119, SLC5A2, MC2R GHSR 59/4885KMT2A 2304/4885MEN1 1253/4885
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R GHSR 2/4885KMT2A 1721/4885MEN1 2250/4885

“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.