SCHEMBL22863341

SCHEMBL22863341

C/C(=C\CCC1(C)Oc2c(c(O)cc3c2CN(CCC[C@@H](C)I)C3=O)CC1O)CCC(O)C(C)(C)O

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PTPN2 P17706 1/20 0.38
▸ PTPN1 P18031 1/20 0.38
▸ PTPN6 P29350 1/20 0.38
▸ DHODH Q02127 1/20 0.32
▸ APP P05067 1/20 0.32
▸ BACE1 P56817 1/20 0.32
▸ ALOX5 P09917 2/20 0.31
▸ CYP3A4 P08684 2/20 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
SCHEMBL29425569 0.91 PTPN2 (0.40) PTPN2PTPN1PTPN6DHODHAPP
SCHEMBL9880209 0.91 PTPN2 (0.40) PTPN2PTPN1PTPN6DHODHAPP
SCHEMBL22863342 0.90 PTPN2 (0.38) PTPN2PTPN1PTPN6DHODHAPP
SCHEMBL22863233 0.90 ALOX5 (0.35) PTPN1APPBACE1ALOX5
SCHEMBL23941689 0.90 ALOX5 (0.35) PTPN1APPBACE1ALOX5
SCHEMBL22863224 0.89 ALOX5 (0.33) ALOX5
SCHEMBL22863210 0.87 ALOX5 (0.40) PTPN1BACE1ALOX5
SCHEMBL21538194 0.84 ALOX5 (0.36) PTPN1APPBACE1ALOX5
SCHEMBL24619629 0.82 ALOX5 (0.37) PTPN1APPBACE1ALOX5
SCHEMBL23941207 0.82 ALOX5 (0.37) PTPN1APPBACE1ALOX5

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 3 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-20210322381-A1 DRUG FOR TREATMENT OR PREVENTION OF BLOOD CEREBRAL HEMORRHAGE, AND METHOD FOR TREATING OR PREVENTING CEREBRAL HEMORRHAGE USING THE DRUG CORXEL PHARMACEUTICALS HONG KONG LIMITED (CN) 2021-10-21 — — 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 (3 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-20210322381-A1 DRUG FOR TREATMENT OR PREVENTION OF BLOOD CEREBRAL HEMORRHAGE, AND METHOD FOR TREATING OR PREVENTING CEREBRAL HEMORRHAGE USING THE DRUG PROC, FABP7, TIMP3 PTPN2 4305/4885PTPN1 4307/4885PTPN6 4172/4885
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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