SCHEMBL24337164

SCHEMBL24337164

CNC(=O)[C@H](NC(=O)[C@H](NC)C(C)C)C(C)C

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.38
MMP9 P14780 1/20 0.38
MMP14 P50281 1/20 0.38
FFAR2 O15552 1/20 0.32
POLB P06746 1/20 0.32
CNR2 P34972 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
CTSS P25774 1/20 0.31
CTSK P43235 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
SCHEMBL22421642 1.00 MMP1 (0.38) MMP1MMP9MMP14FFAR2POLB
SCHEMBL29878045 1.00 MMP1 (0.38) MMP1MMP9MMP14FFAR2POLB
SCHEMBL15033256 1.00 MMP1 (0.38) MMP1MMP9MMP14FFAR2POLB
SCHEMBL19401641 0.91 FFAR2 (0.36) MMP1MMP9MMP14FFAR2
SCHEMBL13260893 0.91 FFAR2 (0.36) MMP1MMP9MMP14FFAR2
SCHEMBL14511336 0.91 FFAR2 (0.36) MMP1MMP9MMP14FFAR2
SCHEMBL17305511 0.84 SMN1; SMN2 (0.42) POLBSMN1; SMN2
SCHEMBL19201191 0.84 FFAR2 (0.32) MMP1FFAR2
SCHEMBL19201193 0.84 FFAR2 (0.32) MMP1FFAR2
SCHEMBL26789813 0.84 MMP1 (0.38) MMP1MMP9MMP14FFAR2POLB

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
WO-2022079445-A1 BICYCLIC PEPTIDE LIGAND DRUG CONJUGATES Bicyclerd Limited (GB) 2022-04-21 WO disclosed
US-9586978-B2 Anti-viral compounds ABBVIE INC. (US) 2017-03-07 US disclosed