SCHEMBL7320871

SCHEMBL7320871

CON(C(=O)Cc1ccc(C(=O)NO)cc1)c1ccc(CN(C)C)c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 20/20 0.49
HDAC1 Q13547 18/20 0.49
HDAC10 Q969S8 9/20 0.49
HDAC8 Q9BY41 9/20 0.49
HDAC3 O15379 7/20 0.49
HDAC2 Q92769 6/20 0.49
NCOR2 Q9Y618 3/20 0.49
HDAC4 P56524 4/20 0.46
HDAC7 Q8WUI4 4/20 0.46
HDAC11 Q96DB2 3/20 0.46
HDAC9 Q9UKV0 3/20 0.46
HDAC5 Q9UQL6 3/20 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
SCHEMBL7321634 0.87 HDAC6 (0.47) HDAC6HDAC1HDAC10HDAC8HDAC3
SCHEMBL7321581 0.81 HDAC6 (0.46) HDAC6HDAC1HDAC10HDAC8HDAC3
SCHEMBL7317100 0.81 HDAC6 (0.47) HDAC6HDAC1HDAC10HDAC8HDAC3
SCHEMBL7314618 0.81 HDAC6 (0.47) HDAC6HDAC1HDAC10HDAC8HDAC3
SCHEMBL7320879 0.77 HDAC6 (0.51) HDAC6HDAC1HDAC10HDAC8HDAC3
SCHEMBL7318858 0.77 HDAC6 (0.49) HDAC6HDAC1HDAC10HDAC8HDAC3
SCHEMBL7317774 0.74 HDAC6 (0.45) HDAC6HDAC1HDAC10HDAC8HDAC3
SCHEMBL7321644 0.73 HDAC6 (0.51) HDAC6HDAC1HDAC10HDAC8HDAC3
SCHEMBL7324518 0.72 HDAC6 (0.47) HDAC6HDAC1HDAC10HDAC8HDAC3
SCHEMBL7321597 0.71 HDAC6 (0.49) HDAC6HDAC1HDAC10HDAC8HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0901465-B1 COMPOUNDS WITH ANTI-INFLAMMATORY AND IMMUNOSUPPRESSIVE ACTIVITIES ITALFARMACO SPA (IT) 2000-09-27 EP disclosed
US-6034096-A Compounds with anti-inflammatory and immunosuppressive activities ITALFARMACO S.P.A. (IT) 2000-03-07 US disclosed