SCHEMBL3372397

SCHEMBL3372397

Cn1c(CNC(=O)Cc2ccccc2)nc2cc(C=CC(=O)NO)ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 20/20 1.00
HDAC8 Q9BY41 7/20 0.74

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
SCHEMBL3372393 1.00 HDAC1 (1.00) HDAC1HDAC8
SCHEMBL3368738 0.91 HDAC1 (1.00) HDAC1HDAC8
SCHEMBL13226903 0.91 HDAC1 (0.83) HDAC1HDAC8
SCHEMBL3368735 0.91 HDAC1 (1.00) HDAC1HDAC8
SCHEMBL13226894 0.90 HDAC1 (0.82) HDAC1HDAC8
SCHEMBL3366966 0.89 HDAC1 (0.80) HDAC1HDAC8
SCHEMBL3366963 0.89 HDAC1 (0.80) HDAC1HDAC8
SCHEMBL3368459 0.87 HDAC1 (1.00) HDAC1HDAC8
SCHEMBL3368463 0.87 HDAC1 (1.00) HDAC1HDAC8
SCHEMBL16788422 0.86 HDAC1 (0.84) HDAC1HDAC8

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
EP-1673349-B1 BENZIMIDAZOLE DERIVATIVES: PREPARATION AND PHARMACEUTICAL APPLICATIONS S BIO PTE LTD (SG) 2010-06-30 EP claimed