SCHEMBL22863219

SCHEMBL22863219

C/C(=C\CCC1(C)Oc2c(c(O)cc3c2CNC3=O)CC1O)CCC(O)C(C)(C)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PTPN2 P17706 1/20 0.42
▸ PTPN1 P18031 1/20 0.42
▸ PTPN6 P29350 1/20 0.42
▸ DHODH Q02127 3/20 0.36
▸ APP P05067 1/20 0.35
▸ BACE1 P56817 1/20 0.35
▸ ALOX5 P09917 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ CYP3A4 P08684 2/20 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
SCHEMBL2624847 0.86 APP (0.38) PTPN1APPBACE1ALOX5
SCHEMBL2624846 0.86 APP (0.38) PTPN1APPBACE1ALOX5
SCHEMBL2624816 0.86 ALOX5 (0.33) APPALOX5
SCHEMBL2624862 0.86 APP (0.38) PTPN1APPBACE1ALOX5
SCHEMBL30678564 0.86 APP (0.38) PTPN1APPBACE1ALOX5
SCHEMBL16406486 0.83 DHODH (0.45) PTPN2PTPN1PTPN6DHODHAPP
SCHEMBL29425569 0.82 PTPN2 (0.40) PTPN2PTPN1PTPN6DHODHAPP
SCHEMBL9880209 0.82 PTPN2 (0.40) PTPN2PTPN1PTPN6DHODHAPP
SCHEMBL22863342 0.79 PTPN2 (0.38) PTPN2PTPN1PTPN6DHODHAPP
SCHEMBL22863341 0.79 PTPN2 (0.38) PTPN2PTPN1PTPN6DHODHAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220218664-A1 DRUG AND METHOD FOR TREATING OR PREVENTING COMPLICATIONS FROM DIABETES, USING SAID DRUG SHOWA UNIVERSITY (JP) 2022-07-14 — — US disclosed
US-20210000794-A1 Drug and Method of Treating or Preventing Renal Disease Using Drug SHOWA UNIVERSITY (JP) 2021-01-07 — — US 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 (2 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-20220218664-A1 DRUG AND METHOD FOR TREATING OR PREVENTING COMPLICATIONS FROM DIABETES, USING SAID DRUG SLC5A2, SLC5A1, IAPP PTPN2 2545/4885PTPN1 2665/4885PTPN6 1905/4885
US-20210000794-A1 Drug and Method of Treating or Preventing Renal Disease Using Drug REN, ATP6V1B1, SLC10A1 PTPN2 2956/4885PTPN1 3029/4885PTPN6 2677/4885

“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.

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