SCHEMBL21879062

SCHEMBL21879062

NOCC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.66
POLB P06746 3/20 0.65
P2RY14 Q15391 1/20 0.65
TP53 P04637 1/20 0.65
ACE P12821 2/20 0.64
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
MAPT P10636 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
HTT P42858 1/20 0.63
ECE1 P42892 4/20 0.60
ERAP2 Q6P179 1/20 0.60
LTA4H P09960 1/20 0.59
ALOX15 P16050 1/20 0.59

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
SCHEMBL21879060 1.00 KDM4E (0.66) KDM4EPOLBP2RY14TP53ACE
SCHEMBL21879116 0.96 LTA4H (0.63) KDM4EPOLBP2RY14TP53ACE
SCHEMBL21879133 0.96 POLB (0.70) KDM4EPOLBP2RY14TP53ACE
SCHEMBL21937712 0.89 MAPT (0.67) KDM4ETP53MEN1KMT2AMAPT
SCHEMBL30127790 0.89 MAPT (0.67) KDM4ETP53MEN1KMT2AMAPT
SCHEMBL26447749 0.89 MAPT (0.67) KDM4ETP53MEN1KMT2AMAPT
SCHEMBL12569733 0.88 MMP9 (0.64) POLBP2RY14TP53
SCHEMBL30051742 0.88 ACE (0.68) P2RY14ACEECE1ERAP2LTA4H
SCHEMBL21937714 0.87 MAPT (0.61) KDM4ETP53MEN1KMT2AMAPT
SCHEMBL30127739 0.87 MAPT (0.61) KDM4ETP53MEN1KMT2AMAPT

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
WO-2024081692-A1 MITHRAMYCIN OXIME DERIVATIVES HAVING INCREASED SELECTIVITY AND ANTI-CANCER ACTIVITY UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2024-04-18 WO disclosed
US-20230132854-A1 MITHRAMYCIN OXIME DERIVATIVES HAVING INCREASED SELECTIVITY AND ANTI-CANCER ACTIVITY UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2023-05-04 US disclosed
US-20200131218-A1 MITHRAMYCIN OXIME AND HYDRAZINE DERIVATIVES HAVING INCREASED SELECTIVITY AND ANTI-CANCER ACTIVITY UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2020-04-30 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-20230132854-A1 MITHRAMYCIN OXIME DERIVATIVES HAVING INCREASED SELECTIVITY AND ANTI-CANCER ACTIVITY TFAM, HSPE1, PRDX3 KDM4E 1642/4885POLB 741/4885P2RY14 4746/4885
US-20200131218-A1 MITHRAMYCIN OXIME AND HYDRAZINE DERIVATIVES HAVING INCREASED SELECTIVITY AND ANTI-CANCER ACTIVITY HMOX1, HSPE1, TFAM KDM4E 1638/4885POLB 1379/4885P2RY14 4651/4885

“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.