SCHEMBL367815

SCHEMBL367815

O=COC1CCCCC1C(=O)Nc1cc(Cl)cc(Cl)c1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 9/20 0.63
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
POLB P06746 1/20 0.48
HTT P42858 1/20 0.48
RAB9A P51151 1/20 0.48
ALDH1A1 P00352 2/20 0.44
CYP2C19 P33261 1/20 0.44
MAPK1 P28482 1/20 0.41
GAA P10253 1/20 0.40

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
SCHEMBL359675 0.78 GRM4 (1.00) GRM4MEN1KMT2APOLBHTT
SCHEMBL367814 0.78 GRM4 (1.00) GRM4MEN1KMT2APOLBHTT
SCHEMBL15060591 0.78 GRM4 (1.00) GRM4MEN1KMT2APOLBHTT
SCHEMBL14698148 0.78 GRM4 (1.00) GRM4MEN1KMT2APOLBHTT
SCHEMBL5519146 0.74 RAB9A (0.61) MEN1KMT2APOLBHTTRAB9A
SCHEMBL17835239 0.73 GRM4 (0.73) GRM4MEN1KMT2APOLBHTT
SCHEMBL2246735 0.71 MEN1 (0.96) GRM4MEN1KMT2AALDH1A1GAA
SCHEMBL20277498 0.71 GRM4 (0.83) GRM4MEN1KMT2APOLBHTT
SCHEMBL11531098 0.70 ALDH1A1 (0.41) MEN1KMT2APOLBHTTRAB9A
SCHEMBL18154026 0.69 MEN1 (0.86) GRM4MEN1KMT2AHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2804870-A1 NOVEL 2-AMINO-4,5,6,8-TETRAHYDROPYRAZOLO[3,4-b]THIAZOLO [4,5-d]AZEPINE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX Pharma S.A. (CH) 2014-11-26 EP disclosed
WO-2013107862-A1 NOVEL 2-AMINO-4,5,6,8-TETRAHYDROPYRAZOLO[3,4-b]THIAZOLO [4,5-d]AZEPINE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA S.A. (CH) 2013-07-25 WO disclosed
EP-2592932-A2 NOVEL TETRAHYDROPYRAZOLO[3,4-B]AZEPINE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Addex Pharma SA (CH) 2013-05-22 EP disclosed
WO-2012009001-A2 NOVEL TETRAHYDROPYRAZOLO[3,4-B]AZEPINE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA S.A. (CH) 2012-01-19 WO disclosed