SCHEMBL21153703

SCHEMBL21153703

NC[C@H](CS)NC[C@H](CS)NCC(N)CS

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.37
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
ANPEP P15144 3/20 0.31
ENPEP Q07075 1/20 0.31
ERAP2 Q6P179 1/20 0.31
ERAP1 Q9NZ08 1/20 0.31

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
SCHEMBL19934776 1.00 OPRK1 (0.37) OPRK1FNTAFNTBANPEPENPEP
SCHEMBL19934679 1.00 OPRK1 (0.37) OPRK1FNTAFNTBANPEPENPEP
Hydrochloric Acid SCHEMBL21084957 0.98 OPRK1 (0.36) OPRK1FNTAFNTBANPEPENPEP
Hydrochloric Acid SCHEMBL21084952 0.98 OPRK1 (0.36) OPRK1FNTAFNTBANPEPENPEP
Hydrochloric Acid SCHEMBL21084950 0.98 OPRK1 (0.36) OPRK1FNTAFNTBANPEPENPEP
SCHEMBL21111319 0.98 OPRK1 (0.38) OPRK1FNTAFNTBANPEPENPEP
SCHEMBL19934670 0.98 OPRK1 (0.38) OPRK1FNTAFNTBANPEPENPEP
SCHEMBL21134687 0.98 OPRK1 (0.38) OPRK1FNTAFNTBANPEPENPEP
SCHEMBL21153274 0.98 OPRK1 (0.38) OPRK1FNTAFNTBANPEPENPEP
SCHEMBL19934633 0.98 OPRK1 (0.38) OPRK1FNTAFNTBANPEPENPEP

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 2 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
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