SCHEMBL23925703

SCHEMBL23925703

Cc1ccc2c(c1CN)OC(=O)C2

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
AKR1B1 P15121 1/20 0.36

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
SCHEMBL6836815 0.70 HDAC1 (0.37) KDM4EALDH1A1HPGDAKR1B1
SCHEMBL13495858 0.69 AKR1B1 (0.44) KDM4EALDH1A1HPGDAKR1B1
SCHEMBL20734708 0.68 AKR1B1 (0.45) KDM4EALDH1A1HPGDAKR1B1
SCHEMBL16112476 0.67 AKR1B1 (0.36) KDM4EALDH1A1HPGDAKR1B1
SCHEMBL9293486 0.64 KDM4E (0.39) KDM4EALDH1A1HPGDAKR1B1
SCHEMBL11124180 0.64 AKR1B1 (0.40) ALDH1A1HPGDAKR1B1
SCHEMBL32673162 0.62 AKR1B1 (0.41) AKR1B1
SCHEMBL11477205 0.62 PSMB5 (0.43) AKR1B1
SCHEMBL2331538 0.61 GRIA1 (0.38) KDM4EALDH1A1HPGDAKR1B1
SCHEMBL6836726 0.61 KDM4E (0.53) KDM4EALDH1A1HPGDAKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230117370-A1 REGIOSELECTIVE SYNTHESIS OF SUBSTITUTED COMPOUNDS OREGON STATE UNIVERSITY (US) 2023-04-20 US claimed
WO-2021211982-A2 REGIOSELECTIVE SYNTHESIS OF SUBSTITUTED COMPOUNDS OREGON STATE UNIVERSITY (US) 2021-10-21 WO claimed
US-20230117370-A1 REGIOSELECTIVE SYNTHESIS OF SUBSTITUTED COMPOUNDS OREGON STATE UNIVERSITY (US) 2023-04-20 US disclosed
WO-2021211982-A2 REGIOSELECTIVE SYNTHESIS OF SUBSTITUTED COMPOUNDS OREGON STATE UNIVERSITY (US) 2021-10-21 WO 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-20230117370-A1 REGIOSELECTIVE SYNTHESIS OF SUBSTITUTED COMPOUNDS CYP2B6, TYR, CYP2D6 KDM4E 1082/4885ALDH1A1 88/4885HPGD 683/4885

“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.