SCHEMBL14679392

SCHEMBL14679392

Cc1cccc(NC(=O)CCN(C)C)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 2/20 0.64
▸ HDAC1 Q13547 2/20 0.64
▸ HDAC2 Q92769 2/20 0.64
▸ HDAC10 Q969S8 2/20 0.64
▸ HDAC11 Q96DB2 2/20 0.64
▸ HDAC8 Q9BY41 2/20 0.64
▸ HDAC6 Q9UBN7 2/20 0.64
▸ HDAC4 P56524 1/20 0.64
▸ HDAC7 Q8WUI4 1/20 0.64
▸ HDAC9 Q9UKV0 1/20 0.64
▸ HDAC5 Q9UQL6 1/20 0.64
▸ NCOR2 Q9Y618 1/20 0.62
▸ NPC1 O15118 1/20 0.59
▸ POLB P06746 1/20 0.59
▸ RAB9A P51151 1/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ HPGD P15428 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ TERT O14746 4/20 0.58
▸ MAPT P10636 1/20 0.57

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
SCHEMBL259122 0.85 HDAC3 (0.61) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL13102519 0.84 HPGD (0.62) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL3651019 0.83 HDAC3 (0.62) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL14679379 0.82 HDAC3 (0.69) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL13994594 0.82 HDAC3 (0.69) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL10122853 0.82 ICMT (0.60) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL2014002 0.81 MEN1 (0.72) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL17376724 0.81 HDAC3 (0.68) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL259380 0.81 HDAC3 (0.68) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL22868061 0.81 HDAC3 (0.68) HDAC3HDAC1HDAC2HDAC10HDAC11

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
US-8367668-B2 Pyridazinone derivatives MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2013-02-05 — — US disclosed
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