SCHEMBL10891102

SCHEMBL10891102

CCCCN(Cc1ccccc1)C(=O)Nc1ccc(C(C)=O)cc1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 14/20 0.71
HDAC1 Q13547 13/20 0.71
HDAC3 O15379 6/20 0.71
HDAC2 Q92769 6/20 0.71
HDAC8 Q9BY41 4/20 0.71
HDAC4 P56524 3/20 0.71
HDAC7 Q8WUI4 3/20 0.71
HDAC9 Q9UKV0 3/20 0.71
HDAC5 Q9UQL6 3/20 0.71
HDAC10 Q969S8 1/20 0.71
HDAC11 Q96DB2 1/20 0.71
ALDH1A1 P00352 2/20 0.67
NPSR1 Q6W5P4 1/20 0.57
EGFR P00533 2/20 0.54
LIMK1 P53667 1/20 0.54
LIMK2 P53671 1/20 0.54
POLB P06746 1/20 0.53

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
SCHEMBL9784395 0.91 HDAC6 (0.72) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL11141720 0.90 HDAC6 (0.77) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL10884486 0.88 HDAC6 (0.65) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL10887379 0.87 HDAC6 (0.70) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL10888099 0.87 HDAC6 (0.67) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL10886652 0.87 HDAC6 (0.70) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL10892687 0.87 HDAC6 (0.70) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL8321305 0.87 HDAC6 (0.55) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL10888424 0.86 HDAC6 (0.65) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL10887705 0.86 HDAC6 (0.65) HDAC6HDAC1HDAC3HDAC2HDAC8

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-4623662-A ANTICHOLESTEROL, ANTILIPEMIC AMERICAN CYANAMID COMPANY (US) 1986-11-18 US disclosed