SCHEMBL21994475

SCHEMBL21994475

CCOC(=O)C(C)(CC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)OCC

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.46
KDM4E B2RXH2 2/20 0.45
PKM P14618 1/20 0.45
RECQL P46063 1/20 0.44
EPHX1 P07099 1/20 0.44
GAA P10253 1/20 0.43
GPR119 Q8TDV5 6/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
DPP4 P27487 1/20 0.43
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.41
FAAH O00519 1/20 0.41

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
SCHEMBL22233243 0.89 HPGD (0.46) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL15247425 0.88 HPGD (0.45) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL7490833 0.86 HPGD (0.44) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL6750166 0.82 HPGD (0.45) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL7834433 0.82 HPGD (0.55) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL9891006 0.81 HPGD (0.44) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL9389313 0.81 HPGD (0.44) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL792459 0.81 HPGD (0.54) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL785988 0.80 HPGD (0.48) HPGDKDM4EPKMRECQLEPHX1
SCHEMBL19995830 0.80 HPGD (0.48) HPGDKDM4EPKMRECQLEPHX1

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-20220031704-A1 NOVEL DUAL MODE OF ACTION SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND PHOSPHODIESTERASE INHIBITORS AND USES THEREOF TOPADUR PHARMA AG (CH) 2022-02-03 US disclosed
EP-3887376-A1 NOVEL DUAL MODE OF ACTION SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND PHOSPHODIESTERASE INHIBITORS AND USES THEREOF Topadur Pharma AG (CH) 2021-10-06 EP disclosed
WO-2020109354-A1 NOVEL DUAL MODE OF ACTION SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND PHOSPHODIESTERASE INHIBITORS AND USES THEREOF TOPADUR PHARMA AG (CH) 2020-06-04 WO disclosed
WO-2020109354-A1 NOVEL DUAL MODE OF ACTION SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND PHOSPHODIESTERASE INHIBITORS AND USES THEREOF TOPADUR PHARMA AG (CH) 2020-06-04 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-20220031704-A1 NOVEL DUAL MODE OF ACTION SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND PHOSPHODIESTERASE INHIBITORS AND USES THEREOF PDE9A, PDE5A, PDE2A HPGD 496/4885KDM4E 2159/4885PKM 3622/4885

“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.