SCHEMBL3347176

SCHEMBL3347176

FCc1cccc(C#CCCc2ccn3nccc3n2)n1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.40
PDE10A Q9Y233 1/20 0.34
DYRK1A Q13627 1/20 0.31
SCN5A Q14524 1/20 0.30

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
SCHEMBL3345876 0.84 GRM5 (0.53) GRM5PDE10A
SCHEMBL3346938 0.82 GRM5 (0.43) GRM5PDE10A
SCHEMBL3351211 0.81 GRM5 (0.56) GRM5PDE10ADYRK1A
SCHEMBL3353377 0.81 GRM5 (0.36) GRM5PDE10A
SCHEMBL3347060 0.79 GRM5 (0.35) GRM5SCN5A
SCHEMBL3347219 0.77 GRM5 (0.37) GRM5PDE10ADYRK1ASCN5A
SCHEMBL3347361 0.77 GRM5 (0.36) GRM5PDE10ADYRK1A
SCHEMBL3346732 0.77 DYRK1A (0.36) GRM5PDE10ADYRK1ASCN5A
SCHEMBL3348887 0.76 GRM5 (0.38) GRM5DYRK1A
SCHEMBL3346239 0.76 GRM5 (0.39) GRM5PDE10ADYRK1ASCN5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010063487-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2010-06-10 WO claimed
WO-2010063487-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2010-06-10 WO disclosed