SCHEMBL24257912

SCHEMBL24257912

CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(-c3ccc(Cl)cc3)cc21

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 12/20 0.48
PGR P06401 2/20 0.41
GCGR P47871 1/20 0.36
MAPK14 Q16539 1/20 0.36
MMP2 P08253 3/20 0.35
MMP9 P14780 3/20 0.35
MMP8 P22894 2/20 0.35
MMP13 P45452 2/20 0.35

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
SCHEMBL26050391 0.95 PDK2 (0.44) PDK2PGRGCGRMAPK14MMP2
SCHEMBL26050352 0.95 PDK2 (0.44) PDK2PGRGCGRMAPK14MMP2
SCHEMBL20927687 0.95 PDK2 (0.44) PDK2PGRGCGRMAPK14MMP2
SCHEMBL22989719 0.95 PDK2 (0.44) PDK2PGRGCGRMAPK14MMP2
SCHEMBL26050398 0.95 PDK2 (0.44) PDK2PGRGCGRMAPK14MMP2
SCHEMBL21037521 0.95 PDK2 (0.44) PDK2PGRGCGRMAPK14MMP2
SCHEMBL24257883 0.95 PDK2 (0.44) PDK2PGRGCGRMAPK14MMP2
SCHEMBL24257897 0.95 PDK2 (0.44) PDK2PGRGCGRMAPK14MMP2
SCHEMBL26050392 0.93 PDK2 (0.43) PDK2PGRGCGRMAPK14MMP2
SCHEMBL1994589 0.92 PDK2 (0.41) PDK2MMP2MMP9MMP8MMP13

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-20230271989-A1 METAL COMPLEXES UDC IRELAND LIMITED (IE) 2023-08-31 US disclosed
US-20230271989-A1 METAL COMPLEXES UDC IRELAND LIMITED (IE) 2023-08-31 US disclosed
WO-2022034046-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2022-02-17 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-20230271989-A1 METAL COMPLEXES AP3M1, AP1M1, AP2M1 PDK2 1385/4885PGR 2872/4885GCGR 4761/4885

“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.