SCHEMBL7324711

SCHEMBL7324711

CCN(CC)Cc1ccc2cc(CN(N)C(=O)c3ccc(C(=O)Cl)cc3)ccc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 4/20 0.44
▸ HDAC1 Q13547 4/20 0.44
▸ HDAC8 Q9BY41 3/20 0.44
▸ HDAC3 O15379 2/20 0.44
▸ HDAC2 Q92769 2/20 0.44
▸ HDAC4 P56524 1/20 0.44
▸ HDAC7 Q8WUI4 1/20 0.44
▸ HDAC10 Q969S8 1/20 0.44
▸ HDAC11 Q96DB2 1/20 0.44
▸ HDAC9 Q9UKV0 1/20 0.44
▸ HDAC5 Q9UQL6 1/20 0.44
▸ NCOR2 Q9Y618 1/20 0.44
▸ HRH3 Q9Y5N1 3/20 0.40
▸ ACHE P22303 2/20 0.40
▸ F2 P00734 1/20 0.36
▸ F10 P00742 1/20 0.36
▸ F7 P08709 1/20 0.36
▸ PTGES O14684 1/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ AOC3 Q16853 1/20 0.36

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
SCHEMBL5393101 0.79 HDAC8 (0.64) HDAC6HDAC8HRH3ACHEMBTPS1
Hydrochloric Acid SCHEMBL9837835 0.77 HDAC8 (0.62) HDAC6HDAC8HRH3ACHEF10
SCHEMBL7324718 0.77 HDAC1 (0.52) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL24503175 0.76 HDAC6 (0.54) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL23563367 0.74 HDAC6 (0.78) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL7315530 0.69 HRH3 (0.50) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL7315600 0.69 HRH3 (0.50) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL7311325 0.68 PTGES (0.48) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL7321539 0.68 PTGES (0.48) HDAC6HDAC1HDAC8HDAC3HDAC2
Hydrochloric Acid SCHEMBL27898665 0.68 HRH3 (0.48) HDAC6HDAC1HDAC8HDAC3HDAC2

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-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
EP-0901465-A1 COMPOUNDS WITH ANTI-INFLAMMATORY AND IMMUNOSUPPRESSIVE ACTIVITIES ITALFARMACO S.p.A. (IT) 1999-03-17 — — EP disclosed
WO-1997043251-A1 COMPOUNDS WITH ANTI-INFLAMMATORY AND IMMUNOSUPPRESSIVE ACTIVITIES ITALFARMACO S.P.A. (IT) 1997-11-20 — — WO disclosed
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