SCHEMBL2406552

SCHEMBL2406552

Cc1oc(-c2ccccc2)nc1CC(=O)NC(c1ccc(C(=O)NO)cc1)C(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.51
POLB P06746 2/20 0.48
MAPT P10636 5/20 0.46
TP53 P04637 4/20 0.46
HDAC6 Q9UBN7 2/20 0.44
PPARA Q07869 5/20 0.43
PPARG P37231 4/20 0.43
PPARD Q03181 1/20 0.42

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
SCHEMBL2407014 0.87 HDAC1 (0.52) KDM4EPOLBMAPTTP53HDAC6
SCHEMBL2406457 0.79 POLB (0.52) KDM4EPOLBMAPTTP53HDAC6
SCHEMBL2413458 0.74 HDAC1 (0.56) HDAC6
SCHEMBL12280148 0.74 HDAC1 (0.56) HDAC6
SCHEMBL2409904 0.74 HDAC6 (0.51) HDAC6
SCHEMBL14260722 0.73 KDM4E (0.74) KDM4ETP53PPARAPPARGPPARD
SCHEMBL4826826 0.72 KDM4E (0.55) KDM4EMAPTTP53PPARAPPARG
SCHEMBL4823431 0.71 KDM4E (0.54) KDM4EPOLBTP53PPARAPPARG
SCHEMBL7004467 0.71 KDM4E (0.53) KDM4EPOLBTP53PPARAPPARG
SCHEMBL12868351 0.70 KDM4E (0.74) KDM4ETP53PPARAPPARGPPARD

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-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-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-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 KDM4E 875/4885POLB 539/4885MAPT 2484/4885
US-20110212969-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC10, HDAC1 KDM4E 875/4885POLB 539/4885MAPT 2484/4885

“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.