SCHEMBL30974255

SCHEMBL30974255

CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
REN P00797 3/20 0.56
CALCRL Q16602 1/20 0.53
CTSC P53634 1/20 0.53
EED O75530 1/20 0.50
PSMB5 P28074 4/20 0.49
MME P08473 1/20 0.48

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
SCHEMBL29958630 0.92 REN (0.58) RENCTSCEEDPSMB5MME
SCHEMBL30123252 0.92 CTSC (0.59) RENCALCRLCTSCMME
SCHEMBL10618805 0.92 CTSC (0.56) RENCALCRLCTSCEEDPSMB5
SCHEMBL10618815 0.92 CTSC (0.56) RENCALCRLCTSCEEDPSMB5
SCHEMBL30052854 0.88 CTSC (0.56) RENCTSCEEDPSMB5MME
SCHEMBL30974565 0.88 DPP7 (0.41) RENCALCRLCTSC
SCHEMBL29634944 0.87 CALCRL (0.54) RENCALCRLCTSC
SCHEMBL10364374 0.87 CTSC (0.59) RENCTSCEEDPSMB5MME
SCHEMBL29430213 0.86 CALCRL (0.55) RENCALCRLCTSC
SCHEMBL31122250 0.86 CALCRL (0.53) RENCALCRLCTSC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024132726-A1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF ACUTE ISCHEMIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF ACUTE ISCHEMIC STROKE FROM INTRACRANIAL HEMORRHAGIC STROKE UNIWERSYTET GDANSKI (PL) 2024-06-27 WO disclosed