SCHEMBL5793608

SCHEMBL5793608

CC[C@H](C)[C@H](N)C(=O)N[C@H]([C]=O)Cc1c[nH]cn1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CIT O14578 1/20 0.34
▸ CTSC P53634 3/20 0.34
▸ TERT O14746 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ PLG P00747 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ HSPA5 P11021 1/20 0.31
▸ HSPA2 P54652 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
SCHEMBL5499034 0.89 CTSC (0.42) CTSC
SCHEMBL9012496 0.89 CTSC (0.42) CTSC
SCHEMBL367751 0.89 CTSC (0.35) CTSC
SCHEMBL8370894 0.89 CTSC (0.35) CTSC
SCHEMBL9012656 0.87 CTRB1 (0.34) CTSC
SCHEMBL9012498 0.87 CTRB1 (0.34) CTSC
SCHEMBL5795275 0.87 CTRB1 (0.34) CTSC
SCHEMBL9012489 0.87 CTRB1 (0.34) CTSC
SCHEMBL9012459 0.83 CTSC (0.37) CTSC
SCHEMBL9012442 0.83 CTSC (0.37) CTSC

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-2006023465-A1 POLYETHYLENE GLYCOL-PEPTIDE COPPER COMPLEXES AND COMPOSITIONS AND METHODS RELATED THERETO PROCYTE CORPORATION (US) 2006-03-02 — — WO disclosed
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