SCHEMBL21891787

SCHEMBL21891787

CCC(N=C=O)OC(=O)C(CCSC)N=C=O

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.32
METAP1 P53582 1/20 0.32
RNPEP Q9H4A4 1/20 0.31

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
SCHEMBL21891742 0.82 RNPEP (0.33) METAP2METAP1RNPEP
SCHEMBL23130163 0.82 RNPEP (0.33) METAP2METAP1RNPEP
SCHEMBL979343 0.81 METAP2 (0.40) METAP2METAP1RNPEP
SCHEMBL21892074 0.81
SCHEMBL21891792 0.81
SCHEMBL6895344 0.80 MIF (0.41) RNPEP
SCHEMBL6895345 0.80 MIF (0.41) RNPEP
SCHEMBL21891745 0.80 RNPEP (0.35) METAP2METAP1RNPEP
SCHEMBL21891764 0.78
SCHEMBL1271467 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10968168-B2 Isocyanate production method ASAHI KASEI KABUSHIKI KAISHA (JP) 2021-04-06 US disclosed
US-20200115327-A1 ISOCYANATE PRODUCTION METHOD ASAHI KASEI KABUSHIKI KAISHA (JP) 2020-04-16 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-20200115327-A1 ISOCYANATE PRODUCTION METHOD IDH3A, ALKBH3, CPS1 METAP2 2477/4885METAP1 3119/4885RNPEP 609/4885
US-10968168-B2 Isocyanate production method IDH3A, ALKBH3, CPS1 METAP2 2477/4885METAP1 3119/4885RNPEP 609/4885

“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.