SCHEMBL1785453

SCHEMBL1785453

CS(=O)(=O)c1ccc2nc(NC(=O)NC(=O)c3ccccc3Br)sc2c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.84
NPC1 O15118 9/20 0.84
GHSR Q92847 4/20 0.80
MEN1 O00255 7/20 0.67
KMT2A Q03164 7/20 0.67
ALDH1A1 P00352 6/20 0.67
KDM4E B2RXH2 5/20 0.67
TP53 P04637 3/20 0.67
HSD17B10 Q99714 2/20 0.67
HPGD P15428 2/20 0.67
NPSR1 Q6W5P4 1/20 0.67
SMN1; SMN2 Q16637 4/20 0.63
RXFP1 Q9HBX9 2/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
LMNA P02545 3/20 0.59
GAA P10253 1/20 0.59
RECQL P46063 1/20 0.59
PKM P14618 1/20 0.59
MAPT P10636 2/20 0.58
POLB P06746 1/20 0.58

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
SCHEMBL1787635 0.90 GHSR (0.80) RAB9ANPC1GHSRMEN1KMT2A
SCHEMBL1785626 0.89 GHSR (0.78) RAB9ANPC1GHSRMEN1KMT2A
SCHEMBL1785629 0.89 GHSR (0.78) RAB9ANPC1GHSRMEN1KMT2A
SCHEMBL1789562 0.89 GHSR (1.00) RAB9ANPC1GHSRMEN1KMT2A
SCHEMBL1787168 0.88 GHSR (0.77) RAB9ANPC1GHSRMEN1KMT2A
SCHEMBL1785644 0.88 GHSR (0.77) RAB9ANPC1GHSRMEN1KMT2A
SCHEMBL1788113 0.87 GHSR (0.75) RAB9ANPC1GHSRMEN1KMT2A
SCHEMBL1788897 0.87 GHSR (0.75) RAB9ANPC1GHSRMEN1KMT2A
SCHEMBL1791193 0.87 GHSR (0.75) RAB9ANPC1GHSRMEN1KMT2A
SCHEMBL1784082 0.86 GHSR (0.74) RAB9ANPC1GHSRMEN1KMT2A

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2607357-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS Astrazeneca AB (SE) 2013-06-26 EP claimed
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2011-05-26 US claimed
EP-2205576-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS AstraZeneca AB (SE) 2010-07-14 EP claimed
US-20090186870-A1 Therapeutic Agents - 802 ASTRAZENECA AB (SE) 2009-07-23 US claimed
WO-2009047558-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2009-04-16 WO claimed
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 RAB9A 2138/4885NPC1 2847/4885GHSR 2/4885
US-20120115845-A1 THERAPEUTIC AGENTS GPR119, MC2R, MC4R RAB9A 1390/4885NPC1 486/4885GHSR 30/4885
US-20090186870-A1 Therapeutic Agents - 802 GPR119, SLC5A2, MC2R RAB9A 2527/4885NPC1 635/4885GHSR 59/4885
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R RAB9A 2138/4885NPC1 2847/4885GHSR 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.