SCHEMBL3368489

SCHEMBL3368489

CCn1c(CN(Cc2ccccc2)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 8/20 0.77

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
SCHEMBL3368483 1.00 HDAC1 (1.00) HDAC1HDAC8
SCHEMBL18102193 0.88 HDAC1 (0.79) HDAC1HDAC8
SCHEMBL3367049 0.88 HDAC1 (1.00) HDAC1HDAC8
SCHEMBL3367050 0.88 HDAC1 (1.00) HDAC1HDAC8
SCHEMBL3369272 0.88 HDAC1 (1.00) HDAC1HDAC8
SCHEMBL3369278 0.88 HDAC1 (1.00) HDAC1HDAC8
SCHEMBL3368410 0.87 HDAC1 (1.00) HDAC1HDAC8
SCHEMBL3368405 0.87 HDAC1 (1.00) HDAC1HDAC8
SCHEMBL3366915 0.85 HDAC1 (1.00) HDAC1HDAC8
SCHEMBL13118362 0.85 HDAC1 (1.00) 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