SCHEMBL19794408

SCHEMBL19794408

CC12CCC(c3c1n1ccc4cc(-c5ccccc5-c5cc(-c6ccccc6-c6ccc7c(ccn8c9c(c(=O)nc78)C7CCC9(C)C7(C)C)c6)cc(-c6ccccc6-c6ccc7c(ccn8c9c(c(=O)nc78)C7CCC9(C)C7(C)C)c6)c5)ccc4c1nc3=O)C2(C)C

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 16/20 0.40
CYP3A4 P08684 3/20 0.35
BCHE P06276 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL15840853 0.85 HSD11B1 (0.44) HSD11B1CYP3A4BCHEALDH1A1LMNA
SCHEMBL15840875 0.84 HSD11B1 (0.43) HSD11B1CYP3A4BCHEALDH1A1
SCHEMBL19801319 0.80 PRKDC (0.32)
SCHEMBL19794366 0.79 HSD11B1 (0.33) HSD11B1CYP3A4LMNA
SCHEMBL19794407 0.76 PRKDC (0.33) ALDH1A1
SCHEMBL15840869 0.76 HSD11B1 (0.39) HSD11B1CYP3A4BCHEALDH1A1LMNA
SCHEMBL17298893 0.74 HSD11B1 (0.44) HSD11B1CYP3A4BCHEALDH1A1LMNA
SCHEMBL15840882 0.74 HSD11B1 (0.44) HSD11B1CYP3A4BCHEALDH1A1LMNA
SCHEMBL17298918 0.74 HSD11B1 (0.46) HSD11B1CYP3A4BCHEALDH1A1LMNA
SCHEMBL19801317 0.74

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-20180026209-A1 Metal Complexes MERCK PATENT GMBH (DE) 2018-01-25 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-20180026209-A1 Metal Complexes AP3M1, AP2M1, SOD1 HSD11B1 4284/4885CYP3A4 2173/4885BCHE 4391/4885

“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.