SCHEMBL22863223

SCHEMBL22863223

CC(CCCC1(C)Oc2c(c(O)cc3c2CN(CCCCC(=O)O)C3=O)CC1O)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ALOX5 P09917 3/20 0.33
▸ NR1I2 O75469 2/20 0.33
▸ PTGER4 P35408 1/20 0.30
▸ AKT1 P31749 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
SCHEMBL22863221 0.90 ALOX5 (0.33) ALOX5NR1I2AKT1
SCHEMBL22863234 0.82 ALOX5 (0.36) KDM4EALDH1A1HPGDALOX5NR1I2
SCHEMBL23941206 0.82 ALOX5 (0.36) KDM4EALDH1A1HPGDALOX5NR1I2
SCHEMBL22863201 0.81 ALOX5 (0.35) KDM4EALDH1A1HPGDALOX5PTGER4
SCHEMBL23941210 0.81 ALOX5 (0.35) KDM4EALDH1A1HPGDALOX5PTGER4
SCHEMBL22863225 0.81 KDM4E (0.33) KDM4EALDH1A1HPGDALOX5PTGER4
SCHEMBL22863342 0.80 PTPN2 (0.38) KDM4EALDH1A1HPGDALOX5PTGER4
SCHEMBL22863208 0.80 ALOX5 (0.42) ALOX5NR1I2
SCHEMBL22863212 0.77 ALOX5 (0.36) ALOX5NR1I2AKT1
SCHEMBL21538195 0.76 ALOX5 (0.35) ALOX5AKT1

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 KDM4E 2773/4885ALDH1A1 911/4885HPGD 197/4885
US-20220218664-A1 DRUG AND METHOD FOR TREATING OR PREVENTING COMPLICATIONS FROM DIABETES, USING SAID DRUG SLC5A2, SLC5A1, IAPP KDM4E 2764/4885ALDH1A1 342/4885HPGD 390/4885
US-20210000794-A1 Drug and Method of Treating or Preventing Renal Disease Using Drug REN, ATP6V1B1, SLC10A1 KDM4E 3932/4885ALDH1A1 571/4885HPGD 91/4885

“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