SCHEMBL17448412

SCHEMBL17448412

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

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ FURIN P09958 10/20 0.34
▸ C3AR1 Q16581 1/20 0.33
▸ PRSS1 P07477 2/20 0.33
▸ REN P00797 1/20 0.33
▸ SIRT6 Q8N6T7 1/20 0.33
▸ SIRT1 Q96EB6 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL18661790 1.00 SMN1; SMN2 (0.34) SMN1; SMN2FURINC3AR1PRSS1REN
SCHEMBL18661754 1.00 SMN1; SMN2 (0.34) SMN1; SMN2FURINC3AR1PRSS1REN
SCHEMBL24571690 0.90 FURIN (0.37) SMN1; SMN2FURINC3AR1PRSS1REN
SCHEMBL26499160 0.90 SMN1; SMN2 (0.34) SMN1; SMN2FURINC3AR1PRSS1REN
SCHEMBL19678198 0.90 FURIN (0.36) SMN1; SMN2FURINC3AR1PRSS1REN
SCHEMBL23220183 0.88 FURIN (0.33) SMN1; SMN2FURINC3AR1PRSS1REN
SCHEMBL19198733 0.88 FURIN (0.33) SMN1; SMN2FURINC3AR1PRSS1REN
SCHEMBL24136141 0.88 FURIN (0.35) FURINPRSS1REN
SCHEMBL24420899 0.88 FURIN (0.33) SMN1; SMN2FURINC3AR1PRSS1REN
SCHEMBL25448089 0.88 FURIN (0.35) SMN1; SMN2FURINC3AR1PRSS1REN

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-20210198314-A1 HEMIASTERLIN DERIVATIVES FOR CONJUGATION AND THERAPY SUTRO BIOPHARMA, INC. 2021-07-01 — — US disclosed
EP-3617221-A1 CYTOTOXIN AND CONJUGATE, USES OF SAME, AND PREPARATION METHOD THEREFOR Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) 2020-03-04 — — EP disclosed
WO-2016008112-A1 LINKERS AND APPLICATION TOWARDS ADC THEREOF MEDSHINE DISCOVERY INC. (CN) 2016-01-21 — — 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-20210198314-A1 HEMIASTERLIN DERIVATIVES FOR CONJUGATION AND THERAPY CYP17A1, HSD17B7, SHBG SMN1; SMN2 2005/4885FURIN 3399/4885C3AR1 2114/4885

“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.

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