SCHEMBL22863355

SCHEMBL22863355

CC(C)=CCC/C(C)=C/CCC1(C)Oc2c(c(O)cc3c2CN(CCC(=O)O)C3=O)CC1O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 8/20 0.37
▸ NR1H4 Q96RI1 2/20 0.35
▸ BACE1 P56817 1/20 0.35
▸ APP P05067 2/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ PSEN1 P49768 1/20 0.34
▸ NR1I2 O75469 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ PPARA Q07869 1/20 0.33

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
SCHEMBL23941477 1.00 ALOX5 (0.37) ALOX5NR1H4BACE1APPPTPN1
SCHEMBL22863234 0.94 ALOX5 (0.36) ALOX5NR1H4BACE1APPPTPN1
SCHEMBL23941206 0.94 ALOX5 (0.36) ALOX5NR1H4BACE1APPPTPN1
SCHEMBL22863201 0.94 ALOX5 (0.35) ALOX5NR1H4BACE1APPPTPN1
SCHEMBL23941210 0.94 ALOX5 (0.35) ALOX5NR1H4BACE1APPPTPN1
SCHEMBL13746651 0.93 APP (0.35) ALOX5NR1H4BACE1APPPTPN1
SCHEMBL22863326 0.92 APP (0.35) ALOX5NR1H4BACE1APPPTPN1
SCHEMBL29406722 0.92 APP (0.35) ALOX5NR1H4BACE1APPPTPN1
SCHEMBL9880208 0.92 APP (0.35) ALOX5NR1H4BACE1APPPTPN1
SCHEMBL15744228 0.92 APP (0.35) ALOX5NR1H4BACE1APPPTPN1

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 ALOX5 71/4885NR1H4 493/4885BACE1 754/4885
US-20210000794-A1 Drug and Method of Treating or Preventing Renal Disease Using Drug REN, ATP6V1B1, SLC10A1 ALOX5 117/4885NR1H4 342/4885BACE1 3094/4885

“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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