SCHEMBL4943381

SCHEMBL4943381

COc1ccc(C2CCN(Cc3nc4cc(Cl)cc5c4n3CCC5)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.44
DRD4 P21917 5/20 0.44
DRD3 P35462 4/20 0.44
GRM2 Q14416 3/20 0.44
POLB P06746 1/20 0.43
ACHE P22303 1/20 0.39
MCHR1 Q99705 1/20 0.38
CHRM4 P08173 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HTT P42858 1/20 0.38
CCR2 P41597 3/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL4943868 0.90 DRD2 (0.51) DRD2DRD4DRD3GRM2ACHE
SCHEMBL4949378 0.90 DRD2 (0.47) DRD2DRD4DRD3GRM2POLB
SCHEMBL4949187 0.89 DRD2 (0.46) DRD2DRD4DRD3GRM2MCHR1
SCHEMBL4948946 0.87 DRD2 (0.44) DRD2DRD4DRD3GRM2ACHE
SCHEMBL4944033 0.85 GRM2 (0.51) DRD2DRD4DRD3GRM2MCHR1
SCHEMBL4948571 0.85 DRD2 (0.48) DRD2DRD4DRD3GRM2POLB
SCHEMBL4950382 0.83 DRD2 (0.56) DRD2DRD4DRD3GRM2MCHR1
SCHEMBL4749767 0.83 DRD2 (0.51) DRD2DRD4DRD3GRM2MCHR1
SCHEMBL4947976 0.83 DRD2 (0.55) DRD2DRD4GRM2CHRM4MAPK1
SCHEMBL4947832 0.83 DRD2 (0.48) DRD2DRD4DRD3GRM2MCHR1

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 129/4885DRD3 94/4885
US-20080318999-A1 Tricyclic Benzimidazoles and Their Use as Metabotropic Glutamate Receptor Modulators GRM2, GRM1, GRIN2B DRD2 51/4885DRD4 129/4885DRD3 94/4885

“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.