SCHEMBL3633738

SCHEMBL3633738

FC(F)(F)c1ccc(-c2n[nH]cc2CNc2ccc(Cl)nc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 3/20 0.45
KCNQ2 O43526 3/20 0.45
KCNQ1 P51787 3/20 0.45
KCNE1 P15382 2/20 0.45
TRPA1 O75762 1/20 0.42
SCN5A Q14524 1/20 0.42
DYRK1A Q13627 2/20 0.42
CLK1 P49759 1/20 0.42
GRM4 Q14833 1/20 0.40
FRK P42685 1/20 0.37
CAMK2B Q13554 1/20 0.37
CAMK2G Q13555 1/20 0.37
CAMK2D Q13557 1/20 0.37
GCGR P47871 7/20 0.37
BRD4 O60885 1/20 0.36
TRPV1 Q8NER1 1/20 0.35
FFAR1 O14842 1/20 0.35
DYRK2 Q92630 1/20 0.35
MAPT P10636 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
SCHEMBL3639200 0.87 CLK1 (0.45) DYRK1ACLK1FRKCAMK2BCAMK2G
SCHEMBL3641215 0.86 MAPT (0.44) DYRK1ACLK1FRKCAMK2BCAMK2G
SCHEMBL3640872 0.86 HDAC1 (0.43) DYRK1ACLK1FRKCAMK2BCAMK2G
SCHEMBL3636650 0.85 ERBB2 (0.43) FRKCAMK2BCAMK2GCAMK2DGCGR
SCHEMBL3639540 0.84 HDAC1 (0.47) DYRK1ACLK1FRKCAMK2BCAMK2G
SCHEMBL3634547 0.84 CLK1 (0.46) DYRK1ACLK1FRKCAMK2BCAMK2G
SCHEMBL3635158 0.82 MAPT (0.44) DYRK1ACLK1GCGRTRPV1MAPT
SCHEMBL3639603 0.82 P2RX1 (0.42) DYRK1ACLK1FRKCAMK2BCAMK2G
SCHEMBL3637862 0.81 ERBB2 (0.43) FRKCAMK2BCAMK2GCAMK2DBRD4
SCHEMBL3637523 0.81 CLK1 (0.41) DYRK1ACLK1FRKCAMK2BCAMK2G

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-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 RECEPTOR) Abbott GmbH & Co. KG (DE) 2010-03-31 EP disclosed
CN-101687790-A Heterocyclic compounds as positive modulators of metabotropic glutamate receptor 2(MGLU2 receptor) ABBOTT GMBH & CO KG 2010-03-31 CN 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 KCNQ3 487/4885KCNQ2 405/4885KCNQ1 478/4885

“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.