SCHEMBL21153320

SCHEMBL21153320

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

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.35
ENPEP Q07075 1/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL19934656 1.00 ANPEP (0.35) ANPEPENPEPKMT2AMEN1
SCHEMBL19934762 0.90 ANPEP (0.32) ANPEPENPEP
SCHEMBL19934872 0.86 MEN1 (0.32) KMT2AMEN1
SCHEMBL19934799 0.83 KMT2A (0.35) KMT2AMEN1
SCHEMBL21135255 0.82 ANPEP (0.38) ANPEPENPEP
SCHEMBL21134808 0.82 ANPEP (0.38) ANPEPENPEP
SCHEMBL21134692 0.82 ANPEP (0.38) ANPEPENPEP
SCHEMBL19934737 0.82 ANPEP (0.38) ANPEPENPEP
SCHEMBL21134702 0.82 ANPEP (0.38) ANPEPENPEP
SCHEMBL19934642 0.82 ANPEP (0.38) ANPEPENPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3508476-B1 AMINO MERCAPTAN COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF IN PROTECTION AGAINST RADIATION SHANGHAI KECHOW PHARMA INC (CN) 2023-11-22 EP disclosed
WO-2020249120-A9 USE OF AMINOTHIOL COMPOUNDS AS CEREBRAL NERVE OR HEART PROTECTIVE AGENT 上海科州药物研发有限公司 2021-12-16 WO disclosed
WO-2020249120-A1 USE OF AMINOTHIOL COMPOUNDS AS CEREBRAL NERVE OR HEART PROTECTIVE AGENT 上海科州药物研发有限公司 2020-12-17 WO 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