SCHEMBL2408207

SCHEMBL2408207

CC(C)C(NC(=O)c1ccc(F)cc1)c1ccc(C(=O)NO)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 7/20 0.73
HDAC6 Q9UBN7 7/20 0.57
HDAC8 Q9BY41 4/20 0.57
NPC1 O15118 1/20 0.54
ALDH1A1 P00352 4/20 0.52
KMT2A Q03164 2/20 0.52
LMNA P02545 1/20 0.52
HPGD P15428 1/20 0.50
MEN1 O00255 1/20 0.48
HTT P42858 1/20 0.48
ANPEP P15144 1/20 0.46
GAA P10253 1/20 0.46
HDAC3 O15379 3/20 0.46
HDAC2 Q92769 2/20 0.46
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

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
SCHEMBL2412513 0.96 HDAC1 (0.68) HDAC1HDAC6HDAC8NPC1ALDH1A1
SCHEMBL2408190 0.86 HDAC1 (0.91) HDAC1HDAC6HDAC8ALDH1A1LMNA
SCHEMBL2405287 0.84 HDAC1 (0.71) HDAC1HDAC6HDAC8ALDH1A1HTT
SCHEMBL2407996 0.82 HDAC1 (0.83) HDAC1HDAC6HDAC8NPC1ALDH1A1
SCHEMBL2407097 0.82 HDAC1 (0.83) HDAC1HDAC6HDAC8NPC1ALDH1A1
SCHEMBL2407392 0.82 HDAC1 (0.69) HDAC1HDAC6HDAC8NPC1ALDH1A1
SCHEMBL2408226 0.82 HDAC1 (0.69) HDAC1HDAC6HDAC8NPC1ALDH1A1
SCHEMBL2407612 0.82 HDAC1 (0.60) HDAC1HDAC6HDAC8ALDH1A1ANPEP
SCHEMBL2408922 0.81 HDAC1 (0.63) HDAC1HDAC6HDAC8HDAC3
SCHEMBL2408049 0.79 HDAC1 (0.64) HDAC1HDAC6HDAC8ALDH1A1HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9382197-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-07-05 US claimed
US-9382197-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-07-05 US disclosed
US-9382197-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-07-05 US disclosed
US-9382197-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-07-05 US disclosed
US-20140275093-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-09-18 US disclosed
US-20140275093-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-09-18 US disclosed
US-20140275093-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-09-18 US disclosed
WO-2011106632-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 WO disclosed
US-20110212969-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 US disclosed
WO-2011106632-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 WO disclosed
US-20110212969-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 US disclosed
US-20110212969-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 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-20140275093-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC10, HDAC1 HDAC1 3/4885HDAC6 1/4885HDAC8 15/4885
US-20110212969-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC10, HDAC1 HDAC1 3/4885HDAC6 1/4885HDAC8 15/4885

“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.