SCHEMBL4947635

SCHEMBL4947635

CC1CCc2cc(F)cc3nc(CN4CCC(CCOc5ccc(F)c(F)c5)CC4)n1c23

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
MOGAT2 Q3SYC2 1/20 0.33
CHEK2 O96017 3/20 0.33
GRM2 Q14416 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MAOA P21397 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
GSK3B P49841 1/20 0.32

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
SCHEMBL4948943 0.92 SLC6A4 (0.37) DRD2DRD4SLC6A2SLC6A4SLC6A3
SCHEMBL4945404 0.90 DRD2 (0.35) DRD2DRD4HTR2AHTR2CCHEK2
SCHEMBL14582409 0.85 DRD2 (0.35) DRD2DRD4CHEK2SLC6A2SLC6A4
SCHEMBL4947343 0.84 MCHR1 (0.36) DRD2DRD4HTR2AMOGAT2CHEK2
SCHEMBL4950357 0.79 ACHE (0.37) DRD2DRD4HTR2AHTR2CSLC6A4
SCHEMBL4948882 0.78 DRD2 (0.42) DRD2DRD4GRM2ACHE
SCHEMBL4754204 0.78 DRD2 (0.42) DRD2DRD4HTR2AHTR2CGRM2
SCHEMBL13993050 0.78 CCR3 (0.44)
SCHEMBL4947266 0.78 GRM2 (0.40) DRD2DRD4GRM2
SCHEMBL4750542 0.77 MCHR1 (0.37) DRD2DRD4CHEK2GRM2MAOA

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-20080318999-A1 Tricyclic Benzimidazoles and Their Use as Metabotropic Glutamate Receptor Modulators ASTRAZENECA AB (SE) 2008-12-25 US claimed
US-20070032469-A1 Tricyclic benzimidazoles and their use as metabotropic glutamate receptor modulators ASTRAZENECA AB (SE) 2007-02-08 US claimed
US-20080318999-A1 Tricyclic Benzimidazoles and Their Use as Metabotropic Glutamate Receptor Modulators ASTRAZENECA AB (SE) 2008-12-25 US disclosed
US-20080318999-A1 Tricyclic Benzimidazoles and Their Use as Metabotropic Glutamate Receptor Modulators ASTRAZENECA AB (SE) 2008-12-25 US disclosed
WO-2007018998-A2 TRICYCLIC BENZIMIDAZOLES AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2007-02-15 WO disclosed
US-20070032469-A1 Tricyclic benzimidazoles and their use as metabotropic glutamate receptor modulators ASTRAZENECA AB (SE) 2007-02-08 US disclosed
US-20070032469-A1 Tricyclic benzimidazoles and their use as metabotropic glutamate receptor modulators ASTRAZENECA AB (SE) 2007-02-08 US 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 (2 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-20070032469-A1 Tricyclic benzimidazoles and their use as metabotropic glutamate receptor modulators GRM2, GRM1, GRIN2B DRD2 51/4885DRD4 129/4885HTR2A 99/4885
US-20080318999-A1 Tricyclic Benzimidazoles and Their Use as Metabotropic Glutamate Receptor Modulators GRM2, GRM1, GRIN2B DRD2 51/4885DRD4 129/4885HTR2A 99/4885

“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.