SCHEMBL19971936

SCHEMBL19971936

COC(=O)[C@@H](CCCNC(=O)OC(C)(C)C)NC(=O)[C@@H](C)NC(=O)[C@H](N)CCCNC(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
GAA P10253 1/20 0.48
TDP1 Q9NUW8 5/20 0.43
MAPT P10636 1/20 0.43
NPY4R P50391 2/20 0.42
NPY1R P25929 1/20 0.42
ATM Q13315 2/20 0.41
NPSR1 Q6W5P4 3/20 0.40
POLB P06746 2/20 0.40
CA1 P00915 5/20 0.40
CA2 P00918 5/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
MMP1 P03956 1/20 0.39
MMP3 P08254 1/20 0.39
MMP9 P14780 1/20 0.39
CA12 O43570 2/20 0.38
CA9 Q16790 2/20 0.38
CTSS P25774 1/20 0.38

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
SCHEMBL19971937 1.00 MEN1 (0.48) MEN1KMT2AGAATDP1MAPT
SCHEMBL8602068 0.92 TDP1 (0.48) MEN1KMT2AGAATDP1MAPT
SCHEMBL17900929 0.88 TDP1 (0.41) MEN1KMT2AGAATDP1MAPT
SCHEMBL21982015 0.88 MEN1 (0.52) MEN1KMT2AGAATDP1MAPT
SCHEMBL19986282 0.88 MEN1 (0.52) MEN1KMT2AGAATDP1MAPT
SCHEMBL21982014 0.88 MEN1 (0.52) MEN1KMT2AGAATDP1MAPT
SCHEMBL19971934 0.87 MEN1 (0.53) MEN1KMT2AGAATDP1MAPT
SCHEMBL30340151 0.86 MEN1 (0.51) MEN1KMT2AGAATDP1MAPT
SCHEMBL22388208 0.86 TDP1 (0.48) MEN1KMT2AGAATDP1MAPT
SCHEMBL22370726 0.86 TDP1 (0.48) MEN1KMT2AGAATDP1MAPT

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-10858389-B2 Solution phase method for preparing etelcalcetide AMGEN INC. (US) 2020-12-08 US disclosed
EP-3274360-B1 SOLUTION PHASE METHOD FOR PREPARING ETELCALCETIDE AMGEN INC (US) 2020-05-06 EP disclosed
US-20180079777-A1 SOLUTION PHASE METHOD FOR PREPARING ETELCALCETIDE AMGEN INC. 2018-03-22 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-10858389-B2 Solution phase method for preparing etelcalcetide PTH1R, CALCR, SOST MEN1 697/4885KMT2A 4698/4885GAA 2503/4885
US-20180079777-A1 SOLUTION PHASE METHOD FOR PREPARING ETELCALCETIDE PTH1R, CALCR, SOST MEN1 697/4885KMT2A 4698/4885GAA 2503/4885

“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.