SCHEMBL2407133

SCHEMBL2407133

CC(NC(=O)OC(C)(C)C)c1ncc(C(=O)OCc2ccccc2)s1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.46
MAPT P10636 3/20 0.46
ATM Q13315 3/20 0.45
PPARA Q07869 1/20 0.43
CTSL P07711 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PTPRB P23467 1/20 0.43
POLB P06746 2/20 0.43
JAK2 O60674 1/20 0.42
NTSR1 P30989 1/20 0.42
CTSS P25774 1/20 0.41
KLK7 P49862 1/20 0.41
KLK5 Q9Y337 1/20 0.41
MEN1 O00255 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPK1 P28482 1/20 0.40

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
SCHEMBL13199727 0.85 ATM (0.52) ATMCTSLCTSS
SCHEMBL12590837 0.85 ATM (0.52) ATMCTSLCTSS
SCHEMBL12590984 0.85 ATM (0.54) ATM
SCHEMBL12590838 0.82 ATM (0.56) ATMCTSLCTSS
SCHEMBL2412304 0.82 KMT2A (0.40) MAPTATML3MBTL1PTPRBKMT2A
SCHEMBL12272036 0.82 TDP1 (0.49) MAPTATML3MBTL1POLBKMT2A
SCHEMBL2408679 0.81 HCAR2 (0.41) MAPTATML3MBTL1PTPRBKMT2A
SCHEMBL12272599 0.79 TDP1 (0.46) MAPTL3MBTL1POLBMEN1KMT2A
Hydrochloric Acid SCHEMBL2406001 0.78 TDP1 (0.45) MAPTL3MBTL1POLBMEN1KMT2A
SCHEMBL2409382 0.77 SYK (0.46) SYKMAPTL3MBTL1POLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9227951-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-01-05 US disclosed
US-9227951-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-01-05 US disclosed
US-20140228416-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-14 US disclosed
US-20140228416-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-14 US disclosed
US-8546588-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-10-01 US disclosed
US-20110213003-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 US disclosed
WO-2011106627-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 WO disclosed
US-20110213003-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 US disclosed
WO-2011106627-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 WO 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-20110213003-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC3 SYK 1357/4885MAPT 2775/4885ATM 3990/4885
US-20140228416-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC3 SYK 1357/4885MAPT 2775/4885ATM 3990/4885

“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.