SCHEMBL24915860

SCHEMBL24915860

COc1cc(C(N)=O)c2nccc(C(C)C)c2c1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RPS6KB1 P23443 18/20 0.52
AURKA O14965 16/20 0.52
KDM4E B2RXH2 1/20 0.51
LMNA P02545 1/20 0.40

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
SCHEMBL24915853 0.88 LMNA (0.50) RPS6KB1AURKAKDM4ELMNA
SCHEMBL24915857 0.85 LMNA (0.39) RPS6KB1AURKAKDM4ELMNA
SCHEMBL24915856 0.85 JAK2 (0.42) RPS6KB1AURKAKDM4ELMNA
SCHEMBL24915854 0.85 MTNR1A (0.43) RPS6KB1AURKAKDM4ELMNA
SCHEMBL24916220 0.84 DPP4 (0.45) KDM4ELMNA
SCHEMBL24915862 0.81 HPGD (0.46) KDM4E
SCHEMBL24915850 0.80 KDM4E (0.47) AURKAKDM4ELMNA
SCHEMBL24915923 0.79 CD38 (0.45) RPS6KB1AURKAKDM4E
SCHEMBL24916219 0.77 PDE10A (0.41) KDM4E
SCHEMBL24915645 0.77 NSD2 (0.44)

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-20230026466-A1 WDR5 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2023-01-26 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-20230026466-A1 WDR5 INHIBITORS AND MODULATORS WDR5, WDR1, WDR3 RPS6KB1 683/4885AURKA 918/4885KDM4E 105/4885

“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.