SCHEMBL4153532

SCHEMBL4153532

Cc1c(NS(C)(=O)=O)cccc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 2/20 0.53
NFE2L2 Q16236 1/20 0.53
NR3C1 P04150 8/20 0.41
PGR P06401 2/20 0.41
NR3C2 P08235 2/20 0.41
AR P10275 2/20 0.41
GLO1 Q04760 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
TP53 P04637 1/20 0.38
JAK2 O60674 4/20 0.37

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
SCHEMBL520862 0.86 KEAP1 (0.44) KEAP1NFE2L2NR3C1PGRNR3C2
SCHEMBL29782337 0.85 BTK (0.40) KEAP1NFE2L2CA12CA1CA2
SCHEMBL17699534 0.85 BTK (0.40) KEAP1NFE2L2CA12CA1CA2
SCHEMBL21929104 0.84 KEAP1 (0.41) KEAP1NFE2L2NR3C1PGRNR3C2
SCHEMBL15649276 0.84 KEAP1 (0.41) KEAP1NFE2L2NR3C1PGRNR3C2
SCHEMBL31562239 0.83 KEAP1 (0.40) KEAP1NFE2L2NR3C1PGRNR3C2
SCHEMBL17699913 0.80 JAK2 (0.38) CA12CA1CA2CA3CA4
SCHEMBL20293692 0.78 LIPE (0.39) JAK2BTKNPC1RAB9A
SCHEMBL12602971 0.78 JAK2 (0.38) CA12CA1CA2CA3CA4
SCHEMBL31381519 0.77 JAK2 (0.39) CA12CA1CA2CA3CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11021486-B2 Coumarin-like cyclic compound as MEK inhibitor and use thereof CSTONE PHARMACEUTICALS (KY) 2021-06-01 US disclosed
EP-3643308-B1 COUMARIN-LIKE CYCLIC COMPOUND AS MEK INHIBITOR AND USE THEREOF CSTONE PHARMACEUTICALS (KY) 2021-05-19 EP disclosed
WO-2020125747-A1 CRYSTAL FORM AND AMORPHOUS FORM OF MEK INHIBITOR AND APPLICATIONS THEREOF 基石药业(苏州)有限公司 2020-06-25 WO disclosed
US-20200148695-A1 COUMARIN-LIKE CYCLIC COMPOUND AS MEK INHIBITOR AND USE THEREOF CSTONE PHARMACEUTICALS (KY) 2020-05-14 US disclosed
EP-3643308-A1 COUMARIN-LIKE CYCLIC COMPOUND AS MEK INHIBITOR AND USE THEREOF CSTONE PHARMACEUTICALS (KY) 2020-04-29 EP disclosed
US-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS COGHLAN MICHAEL JOSEPH 2009-06-11 US disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-20060063759-A1 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY 2006-03-23 US disclosed
EP-1519915-A2 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2005-04-06 EP disclosed
WO-2004052847-A2 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-06-24 WO disclosed
WO-2004052847-A2 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-06-24 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 (4 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-11021486-B2 Coumarin-like cyclic compound as MEK inhibitor and use thereof MAP3K11, MAP3K15, MAP3K20 KEAP1 82/4885NFE2L2 815/4885NR3C1 3654/4885
US-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS NR5A1, NR3C2, NR3C1 KEAP1 1196/4885NFE2L2 496/4885NR3C1 3/4885
US-20200148695-A1 COUMARIN-LIKE CYCLIC COMPOUND AS MEK INHIBITOR AND USE THEREOF MAP3K11, MAP3K15, MAP3K20 KEAP1 82/4885NFE2L2 815/4885NR3C1 3654/4885
US-20060063759-A1 Tricyclic steroid hormone nuclear receptor modulators NR5A1, NR3C2, NR3C1 KEAP1 1265/4885NFE2L2 564/4885NR3C1 3/4885

“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.