SCHEMBL21970089

SCHEMBL21970089

Cc1ccc2c(n1)C(=O)N(C)Cc1ccc(Cl)cc1-2

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.45
GABRG2 P18507 9/20 0.40
GABRB3 P28472 9/20 0.40
GABRA5 P31644 9/20 0.40
GABRA1 P14867 7/20 0.40
GABRA3 P34903 7/20 0.40
GABRA2 P47869 7/20 0.40
GABRA6 Q16445 7/20 0.40
GABRA4 P48169 3/20 0.37
TYMS P04818 1/20 0.36
GABRB2 P47870 1/20 0.36
MMP12 P39900 1/20 0.36
S100A4 P26447 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
SCHEMBL21970099 0.86 DPP4 (0.42) DPP4GABRG2GABRB3GABRA5GABRA1
SCHEMBL21903321 0.84 DPP4 (0.40) DPP4GABRG2GABRB3GABRA5GABRA1
SCHEMBL21971002 0.79 LMNA (0.46) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL13213025 0.78 GABRG2 (0.47) GABRG2GABRB3GABRA5GABRA1GABRA3
SCHEMBL21350132 0.78 S100A4 (0.39) DPP4GABRA1S100A4
SCHEMBL21970112 0.78 GABRG2 (0.40) DPP4GABRG2GABRB3GABRA5GABRA1
SCHEMBL21903254 0.77 PRF1 (0.38) GABRA1
SCHEMBL21970103 0.77 MAP3K5 (0.46) GABRA1
SCHEMBL29985869 0.77 MAP3K5 (0.46) GABRA1
SCHEMBL29985638 0.77 PRF1 (0.38) GABRA1

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-20200140438-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS ALLOSTERIC MODULATORS OF GROUP II METABOTROPIC GLUTAMATE RECEPTORS DOMAIN THERAPEUTICS (FR) 2020-05-07 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-20200140438-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS ALLOSTERIC MODULATORS OF GROUP II METABOTROPIC GLUTAMATE RECEPTORS GRM3, GRM1, GRM2 DPP4 3299/4885GABRG2 37/4885GABRB3 46/4885

“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.