SCHEMBL5304397

SCHEMBL5304397

O=C(C1CCCC1)N1CCCCC1c1nnn(-c2cccc(Cl)c2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 2/20 0.53
GRM5 P41594 4/20 0.52
CPT2 P23786 1/20 0.50

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
SCHEMBL5331792 0.99 GRM5 (0.53) CPT1AGRM5CPT2
SCHEMBL5303640 0.99 CPT1A (0.52) CPT1AGRM5CPT2
SCHEMBL5331799 0.99 GRM5 (0.53) CPT1AGRM5CPT2
SCHEMBL8238657 0.98 GRM5 (0.52) CPT1AGRM5
SCHEMBL8248272 0.97 GRM5 (0.51) CPT1AGRM5
SCHEMBL5482416 0.89 CPT1A (0.58) CPT1ACPT2
SCHEMBL5310710 0.88 GRM5 (0.54) CPT1AGRM5
SCHEMBL5307149 0.88 GRM5 (0.55) CPT1AGRM5
SCHEMBL5331933 0.86 CPT1A (0.52) CPT1ACPT2
SCHEMBL8243796 0.86 CPT1A (0.46) CPT1AGRM5CPT2

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
WO-2007039782-A1 TETRAZOLE DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2007-04-12 WO claimed
WO-2007039782-A1 TETRAZOLE DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2007-04-12 WO disclosed
WO-2007039782-A1 TETRAZOLE DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2007-04-12 WO disclosed