SCHEMBL4154526

SCHEMBL4154526

Cc1cccc2nc(CN3CCCC(CCc4ccc(F)cc4)C3)n(C)c12

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.49
CYP2D6 P10635 5/20 0.42
HRH1 P35367 5/20 0.42
KCNH2 Q12809 3/20 0.42
CHRM1 P11229 2/20 0.42
DRD4 P21917 1/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38

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
SCHEMBL4154130 0.94 MAOB (0.43) MAOBCYP2D6HRH1KCNH2CHRM1
SCHEMBL4142025 0.94 MAOB (0.42) MAOBCYP2D6HRH1KCNH2CHRM1
SCHEMBL4153083 0.90 CCR3 (0.43) CYP2D6HRH1KCNH2CHRM1
SCHEMBL4147399 0.88 MAOB (0.46) MAOBKCNH2DRD4SLC6A4SLC6A3
SCHEMBL4152281 0.85 CYP2D6 (0.53) MAOBCYP2D6HRH1KCNH2CHRM1
SCHEMBL4139579 0.83 CYP2D6 (0.43) MAOBCYP2D6DRD4SLC6A4SLC6A3
SCHEMBL4154027 0.80 CYP2D6 (0.52) MAOBCYP2D6HRH1KCNH2CHRM1
SCHEMBL4139191 0.79 GRM2 (0.55) CYP2D6HRH1KCNH2CHRM1DRD4
SCHEMBL4162777 0.76 SLC6A4 (0.42) SLC6A4SLC6A3
SCHEMBL4151656 0.76 GRM2 (0.57) DRD4

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
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-07-30 US claimed
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-07-30 US disclosed
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-07-30 US disclosed
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-07-30 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 (1 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-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators GRM1, GRIN1, GRM2 MAOB 1025/4885CYP2D6 1251/4885HRH1 215/4885

“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.