SCHEMBL12210946

SCHEMBL12210946

CC1Cn2cc(C(=O)NO)cc2CN1C(=O)CN(C)C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 14/20 0.41
▸ HDAC1 Q13547 5/20 0.39
▸ HDAC3 O15379 3/20 0.39
▸ HDAC2 Q92769 3/20 0.39
▸ HDAC10 Q969S8 3/20 0.39
▸ HDAC8 Q9BY41 3/20 0.39
▸ HDAC7 Q8WUI4 2/20 0.39
▸ HDAC11 Q96DB2 2/20 0.39
▸ HDAC5 Q9UQL6 2/20 0.39
▸ HDAC4 P56524 1/20 0.32
▸ HDAC9 Q9UKV0 1/20 0.32
▸ NCOR2 Q9Y618 1/20 0.30
▸ TLR9 Q9NR96 4/20 0.30
▸ TLR8 Q9NR97 4/20 0.30
▸ TLR7 Q9NYK1 4/20 0.30
▸ KDM4E B2RXH2 1/20 0.30

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
SCHEMBL12211086 0.82 HDAC6 (0.47) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL12211016 0.80 HDAC6 (0.44) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL12211105 0.75 HDAC6 (0.37) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL12210759 0.75 GRM1 (0.44) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL2519323 0.75 HDAC6 (0.53) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL12210784 0.74 HDAC6 (0.64) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL12283635 0.74 HDAC6 (0.41) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL12210760 0.74 HDAC6 (0.46) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL2522196 0.73 HDAC6 (0.67) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL12211023 0.71 HDAC6 (0.36) HDAC6HDAC1HDAC3HDAC2HDAC10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8946223-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-02-03 — — US claimed
US-20150175614-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. 2015-06-25 — — US disclosed
US-20150175614-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. 2015-06-25 — — US disclosed
US-8946223-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-02-03 — — US disclosed
US-8946223-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-02-03 — — US disclosed
WO-2011130163-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-10-20 — — WO disclosed
US-20110251184-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-10-13 — — 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-20150175614-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 HDAC6 1/4885HDAC1 2/4885HDAC3 12/4885
US-20110251184-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 HDAC6 1/4885HDAC1 2/4885HDAC3 12/4885

“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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