SCHEMBL29925751

SCHEMBL29925751

C[C@H](NC(=O)OCc1ccccc1)C(=O)ON1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PREP P48147 2/20 0.54
CTSK P43235 6/20 0.53
CTSL P07711 3/20 0.53
CTSB P07858 3/20 0.53
CTSS P25774 1/20 0.50
CYP1A2 P05177 1/20 0.50
ATM Q13315 1/20 0.49
OPRK1 P41145 2/20 0.48
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP3A4 P08684 2/20 0.47
TSHR P16473 2/20 0.47
ELANE P08246 1/20 0.47

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
SCHEMBL9511304 0.99 PREP (0.55) PREPCTSKCTSLCTSBCTSS
SCHEMBL9510140 0.82 PREP (0.62) PREPCTSKCTSLCTSBCTSS
SCHEMBL6327664 0.81 PREP (0.53) PREPCTSKCTSLCTSBCTSS
SCHEMBL30946598 0.81 CTSK (0.61) CTSKCTSLCTSBCTSSCYP1A2
SCHEMBL15080869 0.81 CTSK (0.61) CTSKCTSLCTSBCTSSCYP1A2
SCHEMBL4432276 0.80 CTSK (0.50) PREPCTSKCTSLCTSBCTSS
SCHEMBL14366653 0.80 CTSK (0.50) PREPCTSKCTSLCTSBCTSS
SCHEMBL10345811 0.80 CTSK (0.50) PREPCTSKCTSLCTSBCTSS
SCHEMBL10679410 0.80 ELANE (0.56) PREPCTSKCTSLCTSBCTSS
SCHEMBL5412160 0.80 MAPT (0.61) CTSKCTSLCTSBCTSSCYP1A2

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-115175735-B Antiviral compounds 吉利德科学公司 2025-03-04 CN disclosed
CN-115087659-A Antiviral compounds 吉利德科学公司 2022-09-20 CN disclosed