SCHEMBL8567946

SCHEMBL8567946

Cc1nc2cnccc2n1Cc1ccc(C(=O)O)cc1F.[NaH]

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.57
HDAC4 P56524 1/20 0.57
HDAC1 Q13547 1/20 0.57
HDAC7 Q8WUI4 1/20 0.57
HDAC2 Q92769 1/20 0.57
HDAC10 Q969S8 1/20 0.57
HDAC11 Q96DB2 1/20 0.57
HDAC8 Q9BY41 1/20 0.57
HDAC6 Q9UBN7 1/20 0.57
HDAC9 Q9UKV0 1/20 0.57
HDAC5 Q9UQL6 1/20 0.57
PTAFR P25105 1/20 0.56
AGTR1 P30556 1/20 0.52
AGTR2 P50052 1/20 0.52
BRD4 O60885 1/20 0.45

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
SCHEMBL8324186 0.88 HDAC3 (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8568173 0.85 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL8570880 0.82
SCHEMBL7496365 0.80
SCHEMBL7501624 0.79
Hydrochloric Acid SCHEMBL8322173 0.79
SCHEMBL6170405 0.75 HDAC1 (0.59) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL7496109 0.75 PTAFR (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL7501906 0.75 PTAFR (0.80) PTAFR
SCHEMBL7497573 0.74 PTAFR (0.78) PTAFR

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
EP-0842175-A1 IMIDAZOPYRIDINE DERIVATIVES BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1998-05-20 EP disclosed
WO-1997006167-A1 IMIDAZOPYRIDINE DERIVATIVES BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1997-02-20 WO disclosed