SCHEMBL14724463

SCHEMBL14724463

CNC(=O)C(C(=O)NO)N(C)Cc1ccc(/C=C/c2ccccc2)nc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 7/20 0.38
▸ HDAC3 O15379 6/20 0.38
▸ HDAC4 P56524 6/20 0.38
▸ HDAC8 Q9BY41 6/20 0.38
▸ HDAC6 Q9UBN7 6/20 0.38
▸ HDAC7 Q8WUI4 3/20 0.37
▸ HDAC2 Q92769 3/20 0.37
▸ HDAC10 Q969S8 3/20 0.37
▸ HDAC11 Q96DB2 3/20 0.37
▸ HDAC9 Q9UKV0 3/20 0.37
▸ HDAC5 Q9UQL6 3/20 0.37
▸ GRM5 P41594 1/20 0.36
▸ MMP2 P08253 1/20 0.36
▸ MMP3 P08254 1/20 0.36
▸ MMP13 P45452 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ HTR5A P47898 1/20 0.35

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
SCHEMBL14715001 0.79 — —
SCHEMBL14714998 0.79 — —
SCHEMBL14715246 0.69 — —
SCHEMBL14715248 0.69 — —
SCHEMBL14714703 0.66 NPC1 (0.45) MMP13ALDH1A1
SCHEMBL21258366 0.64 L3MBTL1 (0.48) ALDH1A1LMNA
SCHEMBL4580522 0.63 MEN1 (0.64) HDAC1HDAC3HDAC4HDAC8HDAC6
SCHEMBL4580523 0.63 MEN1 (0.64) HDAC1HDAC3HDAC4HDAC8HDAC6
SCHEMBL21258364 0.62 MEN1 (0.63) MMP3ALDH1A1
SCHEMBL6413331 0.62 L3MBTL1 (0.54) HDAC1ALDH1A1LMNA

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-2562155-A1 NOVEL HYDROXAMIC ACID DERIVATIVE Taisho Pharmaceutical Co., Ltd. (JP) 2013-02-27 — — EP disclosed
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