SCHEMBL4240892

SCHEMBL4240892

O=C(O)N(CC1C2CCC1CN(Cc1ccccc1)C2)c1ccccc1Cc1cc(F)cc(F)c1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.42
ACHE P22303 4/20 0.39
GRIN2B Q13224 3/20 0.39
DRD2 P14416 1/20 0.36
DRD3 P35462 1/20 0.36
BCHE P06276 1/20 0.36
BACE1 P56817 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
SCHEMBL4249836 0.91 GRIN2B (0.40) SIGMAR1ACHEGRIN2BBCHEBACE1
SCHEMBL4237318 0.89 SIGMAR1 (0.44) SIGMAR1GRIN2BDRD3
SCHEMBL4238209 0.86 PKM (0.42) SIGMAR1ACHEBCHEBACE1
SCHEMBL4248188 0.85 ACHE (0.42) ACHEBCHEBACE1
SCHEMBL4241455 0.85 SIGMAR1 (0.41) SIGMAR1ACHEGRIN2BDRD2DRD3
SCHEMBL4237268 0.83 MEN1 (0.42) SIGMAR1ACHEDRD2
SCHEMBL4242012 0.83 ACHE (0.45) SIGMAR1ACHE
SCHEMBL4242086 0.81 MEN1 (0.42) SIGMAR1ACHEBCHE
SCHEMBL4248181 0.81 ACHE (0.38) ACHEGRIN2BBCHE
SCHEMBL4244048 0.79 GRIN2B (0.37) SIGMAR1GRIN2BBCHE

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090012116-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-01-08 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 (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-20090012116-A1 Muscarinic Receptor Antagonists CHRM3, CHRM2, CHRM5 SIGMAR1 317/4885ACHE 108/4885GRIN2B 421/4885

“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.