SCHEMBL2522196

SCHEMBL2522196

CC1Cn2cc(C(=O)NO)cc2CN1C(=O)c1cccn1C

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 19/20 0.67
▸ HDAC8 Q9BY41 5/20 0.67
▸ HDAC3 O15379 3/20 0.67
▸ HDAC1 Q13547 3/20 0.67
▸ HDAC7 Q8WUI4 2/20 0.67
▸ HDAC2 Q92769 2/20 0.67
▸ HDAC10 Q969S8 2/20 0.67
▸ HDAC5 Q9UQL6 2/20 0.67
▸ HDAC11 Q96DB2 1/20 0.67
▸ HDAC4 P56524 1/20 0.41
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL12210979 0.86 HDAC6 (0.62) HDAC6HDAC8HDAC3HDAC1HDAC7
SCHEMBL12211089 0.82 HDAC6 (0.48) HDAC6HDAC8HDAC3HDAC1HDAC7
SCHEMBL12210526 0.80 HDAC6 (1.00) HDAC6HDAC8HDAC3HDAC1HDAC7
SCHEMBL12210784 0.80 HDAC6 (0.64) HDAC6HDAC8HDAC3HDAC1HDAC7
SCHEMBL16852213 0.79 HDAC6 (0.55) HDAC6HDAC8HDAC3HDAC1HDAC7
SCHEMBL2521620 0.78 HDAC6 (0.87) HDAC6HDAC8HDAC3HDAC1HDAC7
SCHEMBL12211068 0.77 HDAC6 (0.62) HDAC6HDAC8HDAC3HDAC1HDAC7
SCHEMBL12211016 0.76 HDAC6 (0.44) HDAC6HDAC8HDAC3HDAC1HDAC7
SCHEMBL12210728 0.76 HDAC6 (0.75) HDAC6HDAC8HDAC3HDAC1HDAC7
SCHEMBL12210803 0.76 HDAC6 (0.67) HDAC6HDAC8HDAC3HDAC1HDAC7

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 8 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-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
US-8946223-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-02-03 — — US disclosed
US-20110251184-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-10-13 — — US disclosed
US-20110251184-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-10-13 — — US 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 1/4885HDAC8 17/4885HDAC3 12/4885
US-20110251184-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 HDAC6 1/4885HDAC8 17/4885HDAC3 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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