SCHEMBL1165045

SCHEMBL1165045

COC(=O)C=Cc1ccc(CNC(=O)OC(C)(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
CA12 O43570 1/20 0.51
TYR P14679 1/20 0.51
CA7 P43166 1/20 0.51
CA9 Q16790 1/20 0.51
CA14 Q9ULX7 1/20 0.51
NR1H4 Q96RI1 3/20 0.47
AKR1C3 P42330 1/20 0.47
KDM4E B2RXH2 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
HDAC8 Q9BY41 2/20 0.47
KDM1A O60341 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
PTPN1 P18031 1/20 0.46
NAMPT P43490 2/20 0.46
GAA P10253 1/20 0.45
TTR P02766 1/20 0.44
APP P05067 1/20 0.44
HDAC3 O15379 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
SCHEMBL3674926 1.00 CA1 (0.51) CA1CA2CA12TYRCA7
SCHEMBL30944751 0.88 CA12 (0.55) CA1CA2CA12CA7CA9
SCHEMBL6987937 0.88 CA12 (0.55) CA1CA2CA12CA7CA9
SCHEMBL5598393 0.88 L3MBTL1 (0.48) CA1CA2CA12CA7CA14
SCHEMBL5598396 0.88 L3MBTL1 (0.48) CA1CA2CA12CA7CA14
SCHEMBL27908341 0.86 HDAC3 (0.56) HDAC8HDAC6HDAC3HDAC1HDAC2
SCHEMBL3439467 0.85 NR1H4 (0.49) NR1H4KDM4EPTPN1TTRAPP
SCHEMBL31389315 0.85 NR1H4 (0.49) NR1H4KDM4EPTPN1TTRAPP
SCHEMBL1164581 0.85 NR1H4 (0.49) NR1H4KDM4EPTPN1TTRAPP
SCHEMBL3180689 0.82 L3MBTL1 (0.61) CA1CA2CA12CA7CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2451790-A1 HISTONE DEACETYLASE INHIBITORS Anthem Biosciences Private Limited (IN) 2012-05-16 EP disclosed
US-20120101099-A1 HISTONE DEACETYLASE INHIBITORS ANTHEM BIOSCIENCES PRIVATE LIMITED (IN) 2012-04-26 US disclosed
WO-2011021209-A1 HISTONE DEACETYLASE INHIBITORS PORTSMOUTH TECHNOLOGIES LLC (US) 2011-02-24 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 (1 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-20120101099-A1 HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC3, HDAC11 CA1 1036/4885CA2 2841/4885CA12 2469/4885

“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.