SCHEMBL10254207

SCHEMBL10254207

CCCC(=O)N1C2CCC1c1cc(C(=O)NO)ccc12

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 7/20 0.37
▸ SMPD1 P17405 7/20 0.37
▸ HDAC6 Q9UBN7 6/20 0.37
▸ HDAC3 O15379 1/20 0.36
▸ HDAC4 P56524 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC7 Q8WUI4 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ HDAC10 Q969S8 1/20 0.36
▸ HDAC11 Q96DB2 1/20 0.36
▸ HDAC9 Q9UKV0 1/20 0.36
▸ HDAC5 Q9UQL6 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
SCHEMBL10254734 0.80 HDAC6 (0.45) HDAC8SMPD1HDAC6HDAC3HDAC4
SCHEMBL15969748 0.79 HDAC6 (0.52) HDAC8HDAC6HDAC3HDAC1HDAC11
SCHEMBL10253390 0.75 HDAC8 (0.44) HDAC8HDAC6HDAC1
SCHEMBL15969508 0.75 HDAC1 (0.54) HDAC8HDAC6HDAC3HDAC1HDAC2
SCHEMBL10252696 0.75 CA1 (0.52) HDAC8SMPD1HDAC6HDAC3HDAC4
SCHEMBL10283621 0.74 HDAC8 (0.40) HDAC8HDAC6HDAC3HDAC1HDAC2
SCHEMBL10283624 0.73 HDAC6 (0.52) HDAC8HDAC6HDAC3HDAC1
SCHEMBL356659 0.73 HDAC6 (0.58) HDAC8HDAC6HDAC3HDAC4HDAC1
SCHEMBL15969646 0.72 HDAC6 (0.41) HDAC8HDAC6HDAC3HDAC4HDAC1
SCHEMBL10283555 0.71 TLR7 (0.42) HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 — — US disclosed
WO-2012012322-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-01-26 — — WO disclosed
US-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACUTICALS, INC. (US) 2012-01-19 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 HDAC8 13/4885SMPD1 2583/4885HDAC6 1/4885
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 HDAC8 20/4885SMPD1 2218/4885HDAC6 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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