SCHEMBL31662869

SCHEMBL31662869

Cc1cc(-c2ccc(C=O)c(OC(F)F)c2)nn1-c1cnc(F)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 19/20 0.35
GRIN1 Q05586 15/20 0.34
PDE4D Q08499 1/20 0.32

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
SCHEMBL31662955 0.83 SMN1; SMN2 (0.38) PDE4D
SCHEMBL31663086 0.79 GRIN2B (0.35) GRIN2BGRIN1PDE4D
SCHEMBL31663278 0.77 GRIN2B (0.37) GRIN2BGRIN1
SCHEMBL31662999 0.71 GRIN2B (0.35) GRIN2BGRIN1PDE4D
SCHEMBL31662976 0.70 POLB (0.39) GRIN2BGRIN1PDE4D
SCHEMBL31662978 0.68 DRD1 (0.36) PDE4D
SCHEMBL31662953 0.68 DRD1 (0.37) GRIN2BPDE4D
SCHEMBL31663008 0.68 DRD1 (0.41) PDE4D
SCHEMBL31662923 0.67 PDE4A (0.48) GRIN2BPDE4D
SCHEMBL22770894 0.66 GRIN1 (0.46) GRIN2BGRIN1

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-2025149498-A1 BENZYLPIPERIDINE DERIVATIVES AS TRP4 ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES ASTRAZENECA AB (SE) 2025-07-17 WO disclosed