SCHEMBL4776541

SCHEMBL4776541

CCn1ncc2c(-c3cncc(Br)c3)c(CO)c(COC)nc21

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.32
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
RECQL P46063 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL4772589 0.89 MAPT (0.33) PDE10AMAPTTSHRRECQLNPSR1
SCHEMBL27682178 0.88 PDE10A (0.35) PDE10AMAPTTSHRRECQLNPSR1
SCHEMBL4776451 0.86 MAT2A (0.30)
SCHEMBL27682253 0.85 PDE10A (0.36) PDE10AMAPTTSHRRECQLNPSR1
SCHEMBL4777608 0.84 MAPK1 (0.33) PDE10AMAPTTSHRRECQLNPSR1
SCHEMBL4771822 0.84 MAPT (0.35) PDE10AMAPTTSHRRECQLNPSR1
SCHEMBL4770121 0.83 PDE10A (0.33) PDE10AMAPTTSHRRECQLNPSR1
SCHEMBL4772227 0.82 MAPT (0.42) MAPTTSHRNPSR1
SCHEMBL27682201 0.80 KDM4E (0.36) MAPT
SCHEMBL4769988 0.80 PDE10A (0.30) PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1763528-B1 PYRAZOLOPYRIDINE DERIVATIVES ASTELLAS PHARMA INC (JP) 2008-11-26 EP disclosed
CN-1980927-A Pyrazolopyridine derivatives ASTELLAS PHARMA INC (JP) 2007-06-13 CN disclosed
EP-1763528-A1 PYRAZOLOPYRIDINE DERIVATIVES Astellas Pharma Inc. (JP) 2007-03-21 EP disclosed
WO-2006004188-A1 PYRAZOLOPYRIDINE DERIVATIVES ASTELLAS PHARMA INC. (JP) 2006-01-12 WO disclosed