SCHEMBL3639261

SCHEMBL3639261

CCCCN1Cc2cc(OCc3c[nH]nc3-c3ccc(Cl)cc3)ccc2C1=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRF1 P14222 2/20 0.41
GCGR P47871 1/20 0.36
GRM1 Q13255 2/20 0.35
ALOX5AP P20292 1/20 0.35
GRM5 P41594 1/20 0.35
ADAM17 P78536 3/20 0.35
ITGB3 P05106 1/20 0.35
ITGA2B P08514 1/20 0.35
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
PTGES O14684 1/20 0.35
F10 P00742 1/20 0.34
DRD2 P14416 1/20 0.34
DRD5 P21918 1/20 0.34
DRD3 P35462 1/20 0.34

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
SCHEMBL3636636 0.95 GRM1 (0.40) PRF1GRM1ALOX5APGRM5ADAM17
SCHEMBL3639893 0.91 PRF1 (0.40) PRF1GRM1GRM5ADAM17ITGB3
SCHEMBL3632640 0.91 ADAM17 (0.43) PRF1GRM1GRM5ADAM17ITGB3
SCHEMBL3640741 0.91 ADAM17 (0.41) PRF1GRM1GRM5ADAM17ITGB3
SCHEMBL3641208 0.91 PSEN1 (0.40) PRF1GRM1ALOX5APGRM5ADAM17
SCHEMBL3635276 0.91 PRF1 (0.37) PRF1GRM1GRM5ADAM17MAOA
SCHEMBL3635212 0.90 PRF1 (0.40) PRF1GRM1GRM5ADAM17ITGB3
SCHEMBL3635308 0.88 ALOX5AP (0.39) ALOX5APADAM17ITGB3ITGA2BMAOA
SCHEMBL3632696 0.85 ADAM17 (0.44) PRF1GRM1GRM5ADAM17ITGB3
SCHEMBL3635952 0.85 ADAM17 (0.40) PRF1GRM1GRM5ADAM17MAOA

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 7 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 claimed
EP-2167464-B1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 RECEPTOR) ABBVIE DEUTSCHLAND (DE) 2014-12-03 EP claimed
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 4881/4885GCGR 301/4885GRM1 3/4885

“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.