SCHEMBL3136182

SCHEMBL3136182

Cc1csc(S(=O)(=O)N(CC(C)C)c2cc3c(cc2OCc2ccc(C(=O)O)cc2Cl)OCC3)n1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.33
NR1H4 Q96RI1 2/20 0.33
MAPK14 Q16539 1/20 0.32
RORC P51449 1/20 0.32
BCHE P06276 1/20 0.32
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31

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
SCHEMBL3129587 0.89 NR1H4 (0.38) MCL1NR1H4MAPK14RORCKEAP1
SCHEMBL216752 0.87 MCL1 (0.39) MCL1NR1H4RORCPSEN1PSEN2
SCHEMBL3135017 0.86 NR1H4 (0.38) MCL1NR1H4MAPK14RORCKEAP1
SCHEMBL212947 0.86 MCL1 (0.39) MCL1NR1H4RORCPSEN1PSEN2
SCHEMBL3139655 0.84 MRGPRX4 (0.33) MAPK14KEAP1NFE2L2
SCHEMBL213408 0.83 MCL1 (0.34) MCL1
SCHEMBL215592 0.83 MCL1 (0.39) MCL1NR1H4RORCPSEN1PSEN2
SCHEMBL212498 0.81 MCL1 (0.37) MCL1NR1H4RORCPSEN1PSEN2
SCHEMBL213485 0.80 HDAC8 (0.38) MCL1NR1H4
SCHEMBL214911 0.80 HDAC8 (0.38) MCL1NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9181187-B2 Therapeutic agent for urinary excretion disorder ONO PHARMACEUTICAL CO., LTD. (JP) 2015-11-10 US disclosed
EP-2123273-B1 THERAPEUTIC AGENT FOR URINARY EXCRETION DISORDER ONO PHARMACEUTICAL CO (JP) 2013-10-23 EP disclosed
US-20100076038-A1 THERAPEUTIC AGENT FOR URINARY EXCRETION DISORDER ONO PHARMACEUTICAL CO., LTD. (JP) 2010-03-25 US disclosed
EP-2123273-A1 THERAPEUTIC AGENT FOR URINARY EXCRETION DISORDER ONO Pharmaceutical Co., Ltd. (JP) 2009-11-25 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-20100076038-A1 THERAPEUTIC AGENT FOR URINARY EXCRETION DISORDER PTGER1, TMPRSS15, EPDR1 MCL1 4224/4885NR1H4 1549/4885MAPK14 1924/4885

“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.