SCHEMBL22060199

SCHEMBL22060199

CC(C)C(C)C(=S)NC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
EPHX1 P07099 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL2600360 0.78 MEN1 (0.50) MEN1KMT2AEPHX1POLB
SCHEMBL19245418 0.68 POLB (0.43) MEN1KMT2AEPHX1POLB
SCHEMBL10208282 0.68 POLB (0.43) MEN1KMT2AEPHX1POLB
SCHEMBL1276388 0.64 MEN1 (1.00) MEN1KMT2AEPHX1POLB
SCHEMBL2833590 0.63 MEN1 (0.60) MEN1KMT2AEPHX1POLB
SCHEMBL24847191 0.63
SCHEMBL19484935 0.62 MEN1 (0.43) MEN1KMT2AEPHX1POLB
SCHEMBL19484938 0.62 MEN1 (0.43) MEN1KMT2AEPHX1POLB
SCHEMBL583850 0.61
SCHEMBL2601892 0.61

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-20200172575-A1 PEPTIDE COMPOUND AND APPLICATION THEREOF, AND COMPOSITION CONTAINING PEPTIDE COMPOUND XDCEXPLORER (SHANGHAI) CO., LTD. (CN) 2020-06-04 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-20200172575-A1 PEPTIDE COMPOUND AND APPLICATION THEREOF, AND COMPOSITION CONTAINING PEPTIDE COMPOUND KISS1R, VIP, NPY1R MEN1 268/4885KMT2A 3979/4885EPHX1 3986/4885

“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.