SCHEMBL13447241

SCHEMBL13447241

CC(=O)N1[C@H](C=O)CCC1(C)C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ EPHX2 P34913 1/20 0.30

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
SCHEMBL14157266 0.85 FFAR3 (0.33) —
SCHEMBL19897217 0.85 FFAR3 (0.33) —
SCHEMBL19837766 0.76 DDB1 (0.38) SMN1; SMN2
SCHEMBL22443509 0.74 TSHR (0.33) —
SCHEMBL22443506 0.74 TSHR (0.33) —
SCHEMBL16316616 0.72 SMN1; SMN2 (0.32) SMN1; SMN2EPHX2
SCHEMBL19083694 0.71 ATM (0.36) SMN1; SMN2EPHX2
SCHEMBL8289292 0.69 KMT2A (0.32) —
SCHEMBL15925932 0.69 SPHK1 (0.32) SMN1; SMN2
SCHEMBL22453424 0.67 CTSK (0.37) —

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
EP-1385870-B1 PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS SCHERING CORP (US) 2010-03-17 — — EP disclosed
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