SCHEMBL13613689

SCHEMBL13613689

Cc1c(F)ccc2c1C(=O)N(Cc1ccc(C#N)cc1)C2

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PREP P48147 2/20 0.38
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
PARP1 P09874 1/20 0.37
PRMT5 O14744 3/20 0.36
WDR77 Q9BQA1 3/20 0.36
TNF P01375 1/20 0.36
MDM2 Q00987 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
SCHEMBL13613686 0.86 ALDH1A1 (0.43) PREPPARP1
SCHEMBL2020019 0.85 PRMT5 (0.39) PREPCA12CA9PARP1PRMT5
SCHEMBL13613683 0.83 PARP1 (0.52) PREPPARP1
SCHEMBL13613672 0.80 FNTA (0.42)
SCHEMBL13628796 0.79 GRM2 (0.46)
SCHEMBL13613694 0.79 DPP4 (0.39)
SCHEMBL2021328 0.76 FNTA (0.42) PRMT5WDR77
SCHEMBL19242396 0.75 CHRM1 (0.47)
SCHEMBL15729777 0.75 PARP1 (0.49) PREPPARP1PRMT5WDR77
SCHEMBL15729220 0.75 PARP1 (0.44) PREPPARP1PRMT5WDR77TNF

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-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2009-11-05 US disclosed
US-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2009-11-05 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-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators GRM1, GRIN1, GRM3 PREP 3224/4885CA12 4719/4885CA9 4452/4885

“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.