SCHEMBL3635357

SCHEMBL3635357

CCCCN1Cc2cc(OCc3cn(C(=O)OC(C)(C)C)nc3-c3ccc(Cl)cc3)ccc2C1=O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRF1 P14222 1/20 0.36
EGFR P00533 1/20 0.34
ITGB3 P05106 1/20 0.34
ITGA2B P08514 1/20 0.34
PTGES O14684 3/20 0.33
MAPK1 P28482 2/20 0.33
GABRA5 P31644 1/20 0.33
F10 P00742 2/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
HDAC8 Q9BY41 1/20 0.32

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
SCHEMBL3638127 0.86 PPARD (0.36) PRF1EGFRITGB3ITGA2B
SCHEMBL3635244 0.86 RXRA (0.35) PRF1EGFR
SCHEMBL3639868 0.83 GRM1 (0.39) EGFRITGB3ITGA2BF10
SCHEMBL3639261 0.81 PRF1 (0.41) PRF1ITGB3ITGA2BPTGESF10
SCHEMBL3634732 0.79 HRH3 (0.42) ITGB3ITGA2B
SCHEMBL3638843 0.79 RXRA (0.38) ITGB3ITGA2B
SCHEMBL3640816 0.78 RXRA (0.37) EGFRITGB3ITGA2B
SCHEMBL3636636 0.75 GRM1 (0.40) PRF1ITGB3ITGA2BF10
SCHEMBL3800280 0.75 NR1H4 (0.39) EGFR
SCHEMBL3639893 0.73 PRF1 (0.40) PRF1ITGB3ITGA2BF10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9242933-B2 Heterocyclic compounds as positive modulators of metabotropic glutamate receptor 2 (mGlu2 receptor) AbbVie Deutschland GmbH & Co. KG (DE) 2016-01-26 US disclosed
EP-2167464-B1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 RECEPTOR) ABBVIE DEUTSCHLAND (DE) 2014-12-03 EP disclosed
EP-2167464-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 RECEPTOR) Abbott GmbH & Co. KG (DE) 2010-03-31 EP disclosed
WO-2008145616-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 RECEPTOR) ABBOTT GMBH & CO. KG (DE) 2008-12-04 WO disclosed
US-20080300260-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 receptor) ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2008-12-04 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-20080300260-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 receptor) GRM2, GRIN2C, GRM1 PRF1 4881/4885EGFR 2738/4885ITGB3 4702/4885

“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.