SCHEMBL17553676

SCHEMBL17553676

Cn1[nH]nc1CN1CCc2c(-c3ccc(F)cc3F)cc(C(N)=O)nc2C1

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 20/20 0.75

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
SCHEMBL17551405 0.86 GRM2 (1.00) GRM2
SCHEMBL17551269 0.83 GRM2 (1.00) GRM2
SCHEMBL17551304 0.82 GRM2 (1.00) GRM2
SCHEMBL17551287 0.82 GRM2 (1.00) GRM2
SCHEMBL17551060 0.81 GRM2 (1.00) GRM2
SCHEMBL22211168 0.81 GRM2 (0.68) GRM2
SCHEMBL17551395 0.80 GRM2 (1.00) GRM2
SCHEMBL22211226 0.80 GRM2 (0.72) GRM2
SCHEMBL17551272 0.79 GRM2 (1.00) GRM2
SCHEMBL22211208 0.79 GRM2 (0.66) GRM2

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
WO-2016032921-A1 TETRAHYDRONAPHTHYRIDINE DERIVATIVES AS mGluR2-NEGATIVE ALLOSTERIC MODULATORS, COMPOSITIONS, AND THEIR USE MERCK SHARP & DOHME CORP. (US) 2016-03-03 — — WO disclosed
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