SCHEMBL29896791

SCHEMBL29896791

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

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 4/20 0.51
▸ CTSK P43235 4/20 0.51
▸ CA2 P00918 2/20 0.44
▸ CAPN1 P07384 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ C3AR1 Q16581 1/20 0.39
▸ PSENEN Q9NZ42 4/20 0.36
▸ REN P00797 1/20 0.36
▸ PSEN1 P49768 3/20 0.36
▸ PSEN2 P49810 3/20 0.36
▸ APH1B Q8WW43 3/20 0.36
▸ NCSTN Q92542 3/20 0.36
▸ APH1A Q96BI3 3/20 0.36

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
SCHEMBL30389762 0.92 CTSS (0.43) CTSSCTSKCA2CAPN1
SCHEMBL29576686 0.85 MEN1 (0.52) CTSSCTSKCA2CAPN1MEN1
SCHEMBL7106632 0.85 CAPN1 (0.56) CTSSCTSKCAPN1MEN1GAA
SCHEMBL29678534 0.83 ENPEP (0.39) —
SCHEMBL29678646 0.83 ENPEP (0.38) —
SCHEMBL13724091 0.82 PSEN1 (0.43) PSENENPSEN1PSEN2APH1BNCSTN
SCHEMBL29678516 0.82 NPY4R (0.43) —
SCHEMBL29711719 0.82 CTSS (0.45) CTSSCTSKCAPN1MEN1GAA
SCHEMBL2367531 0.81 MEN1 (0.55) CTSSCTSKCAPN1MEN1GAA
SCHEMBL1486276 0.81 MEN1 (0.55) CTSSCTSKCAPN1MEN1GAA

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
CN-115236337-A Improved limulus kit for detecting industrial endotoxin based on dynamic color development method, and use method and application thereof 丹娜(天津)生物科技股份有限公司 2022-10-25 — — CN claimed
CN-115236337-A Improved limulus kit for detecting industrial endotoxin based on dynamic color development method, and use method and application thereof 丹娜(天津)生物科技股份有限公司 2022-10-25 — — CN disclosed
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