SCHEMBL16391925

SCHEMBL16391925

COc1c(Cl)cc2nc(S)oc2c1OC

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 2/20 0.34
GSK3B P49841 1/20 0.34
MAP4K2 Q12851 1/20 0.34
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
NQO2 P16083 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
HPGD P15428 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA13 Q8N1Q1 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TPMT P51580 1/20 0.30
GAA P10253 1/20 0.30
PDE7B Q9NP56 1/20 0.30

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
SCHEMBL16391482 0.87 PGK1 (0.33) PGK1GSK3BMAP4K2NQO2
SCHEMBL16391445 0.85 GPR35 (0.33) PGK1GSK3BMAP4K2ALDH1A1NQO2
SCHEMBL6010736 0.75 NUDT1 (0.30)
SCHEMBL6010848 0.75 ESR1 (0.39) PGK1GSK3BMAP4K2KDM4EALDH1A1
SCHEMBL6010878 0.74
SCHEMBL16391572 0.72 PGK1 (0.44) PGK1GSK3BMAP4K2NQO2GAA
SCHEMBL16391444 0.71
SCHEMBL16391431 0.71 PGK1 (0.32) PGK1
SCHEMBL6010774 0.71 AHR (0.36) ALDH1A1CA12CA1HPGDCA9
SCHEMBL21487325 0.69 MAOB (0.38) KDM4EALDH1A1NQO2HPGDHSD17B10

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
EP-3020718-B1 NOVEL PDE4 INHIBITOR MEIJI SEIKA PHARMA CO LTD (JP) 2018-12-26 EP disclosed
US-9890142-B2 PDE4 inhibitor MEIJI SEIKA PHARMA CO., LTD. (JP) 2018-02-13 US disclosed
US-9890142-B2 PDE4 inhibitor MEIJI SEIKA PHARMA CO., LTD. (JP) 2018-02-13 US disclosed
US-9890142-B2 PDE4 inhibitor MEIJI SEIKA PHARMA CO., LTD. (JP) 2018-02-13 US disclosed
US-9850235-B2 2017-12-26 US disclosed
US-9850235-B2 2017-12-26 US disclosed
US-9850235-B2 2017-12-26 US disclosed
US-20160159783-A1 PDE4 Inhibitor MEIJI SEIKA PHARMA CO., LTD. (JP) 2016-06-09 US disclosed
US-20160159783-A1 PDE4 Inhibitor MEIJI SEIKA PHARMA CO., LTD. (JP) 2016-06-09 US disclosed
US-20160159783-A1 PDE4 Inhibitor MEIJI SEIKA PHARMA CO., LTD. (JP) 2016-06-09 US disclosed
EP-3020718-A1 NOVEL PDE4 INHIBITOR Meiji Seika Pharma Co., Ltd. (JP) 2016-05-18 EP disclosed
EP-3020718-A1 NOVEL PDE4 INHIBITOR Meiji Seika Pharma Co., Ltd. (JP) 2016-05-18 EP disclosed
WO-2015005429-A1 NOVEL PDE4 INHIBITOR Meiji Seikaファルマ株式会社 (JP) 2015-01-15 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-20160159783-A1 PDE4 Inhibitor PDE4A, PDE4B, PDE3B PGK1 2316/4885GSK3B 832/4885MAP4K2 229/4885

“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.