SCHEMBL3635952

SCHEMBL3635952

CCCCN1Cc2cc(OCc3c[nH]nc3-c3cccc(F)c3)ccc2C1=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 3/20 0.40
GRM5 P41594 3/20 0.39
GRM1 Q13255 3/20 0.39
PRF1 P14222 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
EGFR P00533 1/20 0.35
TNIK Q9UKE5 1/20 0.35
F10 P00742 1/20 0.35

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
SCHEMBL3639851 0.95 GRM1 (0.44) ADAM17GRM5GRM1PRF1KDM4E
SCHEMBL3637586 0.91 GRM1 (0.42) ADAM17GRM5GRM1KDM4EALDH1A1
SCHEMBL3632640 0.91 ADAM17 (0.43) ADAM17GRM5GRM1PRF1MAOA
SCHEMBL3640741 0.90 ADAM17 (0.41) ADAM17GRM5GRM1PRF1KDM4E
SCHEMBL3633480 0.90 DRD2 (0.40) ADAM17GRM5GRM1PRF1HRH3
SCHEMBL3635276 0.90 PRF1 (0.37) ADAM17GRM5GRM1PRF1MAOA
SCHEMBL3637081 0.89 ADAM17 (0.39) ADAM17GRM5GRM1KDM4EALDH1A1
SCHEMBL3639581 0.87 ADAM17 (0.40) ADAM17KDM4EALDH1A1HRH3MAOA
SCHEMBL3635212 0.85 PRF1 (0.40) ADAM17GRM5GRM1PRF1KDM4E
SCHEMBL3639893 0.85 PRF1 (0.40) ADAM17GRM5GRM1PRF1F10

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 ADAM17 4441/4885GRM5 5/4885GRM1 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.