SCHEMBL24619629

SCHEMBL24619629

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

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 8/20 0.37
▸ APP P05067 2/20 0.33
▸ PTPN1 P18031 1/20 0.33
▸ NR1H4 Q96RI1 2/20 0.32
▸ BACE1 P56817 1/20 0.32
▸ PSEN1 P49768 1/20 0.31
▸ PTGES O14684 1/20 0.31
▸ NR1I2 O75469 1/20 0.30
▸ PPARG P37231 1/20 0.30
▸ PPARA Q07869 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
SCHEMBL23941207 1.00 ALOX5 (0.37) ALOX5APPPTPN1NR1H4BACE1
SCHEMBL9880202 0.92 ALOX5 (0.45) ALOX5APPPTPN1NR1H4BACE1
SCHEMBL9880204 0.92 ALOX5 (0.45) ALOX5APPPTPN1NR1H4BACE1
SCHEMBL23941689 0.92 ALOX5 (0.35) ALOX5APPPTPN1NR1H4BACE1
SCHEMBL22863233 0.92 ALOX5 (0.35) ALOX5APPPTPN1NR1H4BACE1
SCHEMBL23941478 0.91 ALOX5 (0.35) ALOX5APPPTPN1NR1H4BACE1
SCHEMBL2624852 0.91 ALOX5 (0.36) ALOX5APPPTPN1NR1H4BACE1
SCHEMBL31114965 0.91 ALOX5 (0.36) ALOX5APPPTPN1NR1H4BACE1
SCHEMBL24632196 0.91 ALOX5 (0.36) ALOX5APPPTPN1NR1H4BACE1
SCHEMBL29330492 0.91 ALOX5 (0.36) ALOX5APPPTPN1NR1H4BACE1

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 1 patent. 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

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-20220218664-A1 DRUG AND METHOD FOR TREATING OR PREVENTING COMPLICATIONS FROM DIABETES, USING SAID DRUG SLC5A2, SLC5A1, IAPP ALOX5 71/4885APP 728/4885PTPN1 2665/4885

“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.

Send feedback