SCHEMBL17009592

SCHEMBL17009592

Cc1cc2nc(NC(C)C)c(Cl)nc2cn1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR6 P46095 10/20 0.43
CYP2D6 P10635 3/20 0.43
GLP1R P43220 1/20 0.42
PGK1 P00558 2/20 0.37
SYK P43405 1/20 0.35
PDE10A Q9Y233 1/20 0.35

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
SCHEMBL15567266 0.83 GLP1R (0.41) GPR6CYP2D6GLP1RPGK1PDE10A
SCHEMBL15565354 0.80 GLP1R (0.41) GPR6GLP1RPGK1PDE10A
SCHEMBL16818337 0.79 ALDH1A1 (0.42) GPR6CYP2D6PGK1
SCHEMBL15566210 0.77 GPR6 (0.50) GPR6CYP2D6PGK1
SCHEMBL16818335 0.77 PGK1 (0.40) GPR6CYP2D6PGK1
SCHEMBL17009593 0.74 GPR6 (0.48) GPR6CYP2D6
SCHEMBL16818331 0.73 LATS1 (0.48) GPR6GLP1R
SCHEMBL17009572 0.73 GPR6 (0.48) GPR6CYP2D6PGK1
SCHEMBL17009574 0.73 GPR6 (0.48) GPR6CYP2D6PGK1
SCHEMBL12965817 0.71 CYP1A2 (0.46) GPR6CYP2D6

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
EP-3105230-B1 PYRIDOPYRAZINES MODULATORS OF GPR6 TAKEDA PHARMACEUTICALS CO (JP) 2021-04-07 EP disclosed
US-10597392-B2 Tetrahydropyridopyrazines as modulators of GPR6 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-03-24 US disclosed
US-20190263801-A1 TETRAHYDROPYRIDOPYRAZINES MODULATORS OF GPR6 ENVOY THERAPEUTICS, INC. 2019-08-29 US disclosed
US-10179783-B2 Tetrahydropyridopyrazines as modulators of GPR6 Taketa Pharmaceutical Company Limited (JP) 2019-01-15 US disclosed
US-20170174677-A1 TETRAHYDROPYRIDOPYRAZINES MODULATORS OF GPR6 ENVOY THERAPEUTICS, INC. 2017-06-22 US disclosed
EP-3105230-A1 PYRIDOPYRAZINES MODULATORS OF GPR6 Takeda Pharmaceutical Company Limited (JP) 2016-12-21 EP disclosed
WO-2015123505-A1 PYRIDOPYRAZINES MODULATORS OF GPR6 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-08-20 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-10597392-B2 Tetrahydropyridopyrazines as modulators of GPR6 GPR6, GPR65, GPR52 GPR6 1/4885CYP2D6 153/4885GLP1R 100/4885
US-10179783-B2 Tetrahydropyridopyrazines as modulators of GPR6 GPR6, GPR65, GPR52 GPR6 1/4885CYP2D6 153/4885GLP1R 100/4885
US-20190263801-A1 TETRAHYDROPYRIDOPYRAZINES MODULATORS OF GPR6 GPR6, GPR52, GPR65 GPR6 1/4885CYP2D6 161/4885GLP1R 113/4885
US-20170174677-A1 TETRAHYDROPYRIDOPYRAZINES MODULATORS OF GPR6 GPR6, GPR52, GPR65 GPR6 1/4885CYP2D6 161/4885GLP1R 113/4885

“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.