SCHEMBL3706149

SCHEMBL3706149

COc1cc(Cl)c(C(=O)O)cc1-n1cccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.41
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
G6PD P11413 1/20 0.40
HCRTR1 O43613 6/20 0.39
HCRTR2 O43614 6/20 0.39
NPC1 O15118 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
KCNH2 Q12809 1/20 0.38
IRAK4 Q9NWZ3 2/20 0.37
CLCN2 P51788 1/20 0.37
LRRK2 Q5S007 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
CYP1A2 P05177 1/20 0.36

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
SCHEMBL1785351 0.88 CAPN1 (0.42) GHSRALDH1A1MEN1KMT2AMAPT
SCHEMBL1784466 0.88 GHSR (0.42) GHSRALDH1A1MEN1KMT2AMAPT
SCHEMBL3702097 0.86 PTGDR (0.39) ALDH1A1MEN1KMT2AMAPTKDM4E
SCHEMBL3704400 0.83 ALDH1A1 (0.46) GHSRALDH1A1MEN1KMT2AMAPT
SCHEMBL3709384 0.82 ALDH1A1 (0.42) ALDH1A1MEN1KMT2AMAPTKDM4E
SCHEMBL1790817 0.80 ACLY (0.45) ALDH1A1MEN1KMT2AMAPTKDM4E
SCHEMBL16464259 0.77 MYC (0.46) ALDH1A1MEN1KMT2AMAPTKDM4E
SCHEMBL1786846 0.77 HCAR1 (0.47) GHSRALDH1A1KDM4ELMNAHCRTR1
SCHEMBL1784772 0.77 HSP90AA1 (0.37) GHSRALDH1A1MEN1KMT2AMAPT
SCHEMBL1785903 0.76 MAPT (0.41) GHSRALDH1A1MEN1KMT2AMAPT

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 3 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 disclosed
EP-2205576-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS AstraZeneca AB (SE) 2010-07-14 EP disclosed
WO-2009047558-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2009-04-16 WO disclosed