SCHEMBL4947683

SCHEMBL4947683

CC(C)(C)C1CC(CCOc2ccc(F)c(F)c2)CCN1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.44
TEAD1 P28347 1/20 0.39
TEAD3 Q99594 1/20 0.39
TDP1 Q9NUW8 1/20 0.36
PPARD Q03181 2/20 0.36
KCNH2 Q12809 1/20 0.36
FFAR1 O14842 1/20 0.36
PPARG P37231 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
KDM1A O60341 1/20 0.36
MCHR1 Q99705 1/20 0.36

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
SCHEMBL4744702 0.88 TEAD1 (0.43) TEAD1TEAD3
SCHEMBL4949281 0.86 TEAD1 (0.38) GPR119TEAD1TEAD3PPARDPPARG
SCHEMBL4140112 0.76 GPR119 (0.71) GPR119
SCHEMBL4951736 0.73 MAOB (0.46)
SCHEMBL5345793 0.73 SMYD3 (0.38)
SCHEMBL21381104 0.72 MAPT (0.41) KDM1A
SCHEMBL4946102 0.72 CCR5 (0.41) PPARG
SCHEMBL3503291 0.72 GPR119 (0.31) GPR119
SCHEMBL619575 0.71 TYMP (0.33)
SCHEMBL17745093 0.71 MEN1 (0.35) TEAD1TEAD3MCHR1

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 2 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 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 GPR119 86/4885TEAD1 3291/4885TEAD3 3018/4885
US-20080318999-A1 Tricyclic Benzimidazoles and Their Use as Metabotropic Glutamate Receptor Modulators GRM2, GRM1, GRIN2B GPR119 86/4885TEAD1 3291/4885TEAD3 3018/4885

“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.