SCHEMBL1787071

SCHEMBL1787071

CCOc1cc(C(=O)O)c(Cl)cc1OC

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.57
HSD17B10 Q99714 1/20 0.57
LCK P06239 1/20 0.49
FYN P06241 1/20 0.49
CYP3A4 P08684 1/20 0.49
LMNA P02545 1/20 0.48
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 2/20 0.46
RCE1 Q9Y256 1/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPK1 P28482 2/20 0.45
LRRK2 Q5S007 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.44
TP53 P04637 1/20 0.44
NPC1 O15118 1/20 0.43
MITF O75030 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL2818164 0.88 LCK (0.60) LCKFYNCYP3A4KDM4EALDH1A1
SCHEMBL1785107 0.86 MAPK1 (0.55) TSHRHSD17B10CYP3A4LMNAKDM4E
SCHEMBL3375031 0.83 MAPT (0.48) LCKFYNCYP3A4KDM4EALDH1A1
SCHEMBL18309198 0.81 TSHR (0.66) TSHRHSD17B10LCKFYNCYP3A4
SCHEMBL8041162 0.81 CTSV (0.60) MRGPRX4NPC1RAB9ASMN1; SMN2
SCHEMBL17892946 0.81 TSHR (0.53) TSHRHSD17B10CYP3A4LMNAALDH1A1
SCHEMBL9984540 0.81 TSHR (0.61) TSHRHSD17B10LCKFYNCYP3A4
SCHEMBL7797972 0.81 TSHR (0.53) TSHRHSD17B10LCKFYNCYP3A4
SCHEMBL15048783 0.81 HSD17B10 (0.49) TSHRHSD17B10CYP3A4LMNAKDM4E
SCHEMBL11557526 0.80 ENPP1 (0.54) TSHRCYP3A4KDM4EALDH1A1MEN1

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 TSHR 35/4885HSD17B10 1559/4885LCK 3350/4885
US-20120115845-A1 THERAPEUTIC AGENTS GPR119, MC2R, MC4R TSHR 230/4885HSD17B10 995/4885LCK 3012/4885
US-20090186870-A1 Therapeutic Agents - 802 GPR119, SLC5A2, MC2R TSHR 333/4885HSD17B10 790/4885LCK 3356/4885
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R TSHR 35/4885HSD17B10 1559/4885LCK 3350/4885

“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.