SCHEMBL24920451

SCHEMBL24920451

CNCC(C(=O)NC)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KISS1R Q969F8 4/20 0.38
MMP2 P08253 6/20 0.34
MMP1 P03956 6/20 0.34
MMP3 P08254 5/20 0.34
MMP9 P14780 5/20 0.34
MMP8 P22894 4/20 0.34
MMP13 P45452 2/20 0.34
ADAM17 P78536 5/20 0.33
MMP7 P09237 2/20 0.33
TNF P01375 2/20 0.33
MMP20 O60882 1/20 0.33
ADAMTS4 O75173 1/20 0.33
MMP10 P09238 1/20 0.33
MMP12 P39900 1/20 0.33
MMP14 P50281 1/20 0.33
MMP15 P51511 1/20 0.33
MMP16 P51512 1/20 0.33
MMP25 Q9NPA2 1/20 0.33
MMP26 Q9NRE1 1/20 0.33
ADAMTS5 Q9UNA0 1/20 0.33

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
SCHEMBL20259542 0.78 USP2 (0.36) MMP2MMP1MMP3MMP9MMP8
SCHEMBL17476051 0.78 SLC1A3 (0.46) KISS1RANPEPECE1SLC1A3SLC1A2
SCHEMBL16057294 0.78 SLC1A3 (0.46) KISS1RANPEPECE1SLC1A3SLC1A2
SCHEMBL15314107 0.78 USP2 (0.36) MMP2MMP1MMP3MMP9MMP8
SCHEMBL16057295 0.78 SLC1A3 (0.46) KISS1RANPEPECE1SLC1A3SLC1A2
SCHEMBL13114608 0.78 USP2 (0.36) MMP2MMP1MMP3MMP9MMP8
SCHEMBL18656804 0.76 MMP2 (0.36) MMP2MMP1MMP3MMP9MMP8
SCHEMBL19156077 0.76 ALDH1A1 (0.46) MMP2MMP1MMP3MMP9MMP8
SCHEMBL16418389 0.76 MMP1 (0.49) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7758279 0.75

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-2023006097-A1 BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUND AND USE THEREOF AS ANDROGEN RECEPTOR DEGRADER 海创药业股份有限公司 2023-02-02 WO disclosed