SCHEMBL2407249

SCHEMBL2407249

C[C@@H](NS(=O)(=O)c1ccc(C(F)(F)F)cc1)c1ccc(C(=O)OC(C)(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.53
CYP2C19 P33261 4/20 0.53
CYP2C9 P11712 3/20 0.53
MAPK1 P28482 2/20 0.53
EEF2K O00418 2/20 0.50
MMP7 P09237 2/20 0.48
MMP9 P14780 2/20 0.48
MMP13 P45452 2/20 0.48
MMP1 P03956 1/20 0.48
MMP2 P08253 1/20 0.48
MMP3 P08254 1/20 0.48
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA12 O43570 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MMP10 P09238 1/20 0.45
SLC1A3 P43003 1/20 0.44
SLC1A2 P43004 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
SCHEMBL2412284 1.00 CYP3A4 (0.53) CYP3A4CYP2C19CYP2C9MAPK1EEF2K
SCHEMBL2412670 0.83 MMP7 (0.52) CYP3A4CYP2C19CYP2C9MAPK1EEF2K
SCHEMBL2413093 0.83 MMP7 (0.52) CYP3A4CYP2C19CYP2C9MAPK1EEF2K
SCHEMBL2411726 0.79 MMP7 (0.46) CYP3A4CYP2C19CYP2C9MAPK1EEF2K
SCHEMBL2411724 0.79 MMP7 (0.46) CYP3A4CYP2C19CYP2C9MAPK1EEF2K
SCHEMBL11887279 0.78 CES2 (0.55) CA1CA2CA12CA9CA14
SCHEMBL2413447 0.76 ALDH1A1 (0.52) CYP2C19MMP1CA1CA2CA12
SCHEMBL2408091 0.74 HDAC8 (0.64) EEF2KSLC1A2POLBGAAMAPT
SCHEMBL2407247 0.74 EEF2K (0.55) CYP3A4CYP2C19CYP2C9MAPK1EEF2K
SCHEMBL2409311 0.72 MMP7 (0.54) CYP3A4CYP2C19CYP2C9MAPK1EEF2K

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 6 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 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 CYP3A4 2945/4885CYP2C19 2230/4885CYP2C9 1768/4885
US-20110212969-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC10, HDAC1 CYP3A4 2945/4885CYP2C19 2230/4885CYP2C9 1768/4885

“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.