SCHEMBL21134692

SCHEMBL21134692

CNC[C@H](CS)NC[C@@H](CS)NC

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.38
ENPEP Q07075 1/20 0.38
OPRD1 P41143 1/20 0.33
OPRK1 P41145 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
SCHEMBL21134808 1.00 ANPEP (0.38) ANPEPENPEPOPRD1OPRK1
SCHEMBL21135255 1.00 ANPEP (0.38) ANPEPENPEPOPRD1OPRK1
SCHEMBL19934737 1.00 ANPEP (0.38) ANPEPENPEPOPRD1OPRK1
SCHEMBL19934642 1.00 ANPEP (0.38) ANPEPENPEPOPRD1OPRK1
SCHEMBL28678248 1.00 ANPEP (0.38) ANPEPENPEPOPRD1OPRK1
SCHEMBL21134702 1.00 ANPEP (0.38) ANPEPENPEPOPRD1OPRK1
Hydrochloric Acid SCHEMBL21084904 0.98 ANPEP (0.36) ANPEPENPEPOPRD1OPRK1
Hydrochloric Acid SCHEMBL21084965 0.98 ANPEP (0.36) ANPEPENPEPOPRD1OPRK1
Hydrochloric Acid SCHEMBL21084943 0.98 ANPEP (0.36) ANPEPENPEPOPRD1OPRK1
Hydrochloric Acid SCHEMBL21084942 0.98 ANPEP (0.36) ANPEPENPEPOPRD1OPRK1

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-11008286-B2 Amino mercaptan compound and preparation method therefor and use thereof in protection against radiation SHANGHAI KECHOW PHARMA, INC (CN) 2021-05-18 US disclosed
EP-3508476-A1 AMINO MERCAPTAN COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF IN PROTECTION AGAINST RADIATION Inst Of Radiation Medicine Chinese Acad Of Medical Sciences (CN) 2019-07-10 EP disclosed
US-20190202779-A1 AMINO MERCAPTAN COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF IN PROTECTION AGAINST RADIATION SHANGHAI KECHOW PHARMA, INC. (CN) 2019-07-04 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 (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-20190202779-A1 AMINO MERCAPTAN COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF IN PROTECTION AGAINST RADIATION MGMT, PRMT8, SULT1A1 ANPEP 2983/4885ENPEP 2353/4885OPRD1 936/4885
US-11008286-B2 Amino mercaptan compound and preparation method therefor and use thereof in protection against radiation MGMT, GSTA1, PRMT1 ANPEP 737/4885ENPEP 540/4885OPRD1 1603/4885

“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.