SCHEMBL9504695

SCHEMBL9504695

CCCCCCCCCCCCCCCCCC=Cc1ccc(C(=O)NO)cc1

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.51
HDAC1 Q13547 3/20 0.50
HDAC6 Q9UBN7 2/20 0.47
KDM1A O60341 1/20 0.47
SMPD1 P17405 4/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
ASAH2 Q9NR71 1/20 0.46

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
SCHEMBL9504690 1.00 TNNC1 (0.51) TNNC1HDAC1HDAC6KDM1ASMPD1
SCHEMBL9504807 1.00 TNNC1 (0.51) TNNC1HDAC1HDAC6KDM1ASMPD1
SCHEMBL9504363 1.00 TNNC1 (0.51) TNNC1HDAC1HDAC6KDM1ASMPD1
SCHEMBL9504360 1.00 TNNC1 (0.51) TNNC1HDAC1HDAC6KDM1ASMPD1
SCHEMBL9504799 1.00 TNNC1 (0.51) TNNC1HDAC1HDAC6KDM1ASMPD1
SCHEMBL9508285 0.86 TNNC1 (0.50) TNNC1HDAC1HDAC6HDAC3HDAC4
SCHEMBL9508291 0.86 TNNC1 (0.50) TNNC1HDAC1HDAC6HDAC3HDAC4
SCHEMBL9508817 0.85 TNNC1 (0.49) TNNC1HDAC1HDAC6HDAC3HDAC4
SCHEMBL9508811 0.85 TNNC1 (0.49) TNNC1HDAC1HDAC6HDAC3HDAC4
SCHEMBL23495873 0.84 TNNC1 (0.53) TNNC1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0161939-B1 ARYLHYDROXAMATES E.R. Squibb & Sons, Inc. (US) 1993-07-21 EP disclosed
CN-85104470-A The method for preparing arythydroxamtes 1986-10-01 CN disclosed
US-4607053-A L2POXYGENASE INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1986-08-19 US disclosed
EP-0161939-A2 Arylhydroxamates E.R. Squibb & Sons, Inc. (US) 1985-11-21 EP disclosed