SCHEMBL2575457

SCHEMBL2575457

COc1cc(NC(=O)N(S)c2cccc(Br)c2O)cc(OC)c1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.46
ALDH1A1 P00352 4/20 0.44
MAPT P10636 4/20 0.44
POLB P06746 3/20 0.44
GFER P55789 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
HTT P42858 2/20 0.42
USP2 O75604 1/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.42
MAPK10 P53779 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ATM Q13315 1/20 0.42
ABCB1 P08183 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
THRB P10828 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL6817060 0.71 MAPT (0.54) ALDH1A1MAPTPOLBGFERSMN1; SMN2
SCHEMBL2575455 0.71 KDM4E (0.53) BCHEALDH1A1MAPTPOLBGFER
SCHEMBL4357296 0.70 POLB (0.56) BCHEALDH1A1MAPTPOLBGFER
SCHEMBL2769848 0.68 MAPT (0.61) ALDH1A1MAPTPOLBSMN1; SMN2HTT
SCHEMBL4354035 0.66 MEN1 (0.42) ALDH1A1MAPTNPSR1MEN1KMT2A
SCHEMBL29663729 0.65 MAPT (0.69) ALDH1A1MAPTPOLBGFERSMN1; SMN2
SCHEMBL6228508 0.65 BCHE (0.43) BCHEALDH1A1MAPTPOLBGFER
SCHEMBL7617608 0.65 PTAFR (0.49) ALDH1A1MAPTPOLBGFERSMN1; SMN2
SCHEMBL4348931 0.65 ALDH1A1 (0.56) BCHEALDH1A1MAPTPOLBGFER
SCHEMBL11174516 0.65 MAPK1 (0.48) ALDH1A1MAPTPOLBGFERSMN1; SMN2

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-8629168-B2 Benzoxazoles and oxazolopyridines being useful as janus kinases inhibitors NOVARTIS AG (CH) 2014-01-14 US disclosed
EP-2066647-B1 BENZOXAZOLES AND OXAZOLOPYRIDINES BEING USEFUL AS JANUS KINASES INHIBITORS NOVARTIS AG (CH) 2011-11-09 EP disclosed
US-20100009978-A1 Benzoxazoles and Oxazolopyridines Being Useful as Janus Kinases Inhibitors NOVARTIS AG 2010-01-14 US disclosed
EP-2066647-A1 BENZOXAZOLES AND OXAZOLOPYRIDINES BEING USEFUL AS JANUS KINASES INHIBITORS Novartis AG (CH) 2009-06-10 EP disclosed
WO-2008031594-A1 BENZOXAZOLES AND OXAZOLOPYRIDINES BEING USEFUL AS JANUS KINASES INHIBITORS NOVARTIS AG (CH) 2008-03-20 WO disclosed
EP-1900729-A1 Benzoxazoles and oxazolopyridines being useful as Janus kinases inhibitors Novartis AG (CH) 2008-03-19 EP 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-20100009978-A1 Benzoxazoles and Oxazolopyridines Being Useful as Janus Kinases Inhibitors JAK2, JAK3, JAK1 BCHE 4741/4885ALDH1A1 1245/4885MAPT 4446/4885

“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.