SCHEMBL2528026

SCHEMBL2528026

CCOC(=O)N1CC2(CC2)C[C@H](C(=O)NO)[C@H]1C(=O)N1CCN(c2ccccc2)CC1

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADAM10 O14672 20/20 0.72
MMP2 P08253 18/20 0.72
ERBB2 P04626 10/20 0.72
MMP9 P14780 12/20 0.72
MMP3 P08254 6/20 0.72
MMP12 P39900 1/20 0.58
MMP14 P50281 1/20 0.58
ADAM8 P78325 1/20 0.58
ADAM17 P78536 1/20 0.58
ADAM33 Q9BZ11 1/20 0.58

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
SCHEMBL2530093 1.00 ADAM10 (0.72) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL2526870 0.94 ADAM10 (0.69) ADAM10MMP2ERBB2MMP9MMP3
Aderbasib SCHEMBL206421 0.92 ADAM10 (0.76) ADAM10MMP2ERBB2MMP9MMP3
Aderbasib SCHEMBL1366560 0.92 ADAM10 (0.76) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL1364313 0.91 ADAM10 (0.70) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL1366083 0.88 ADAM10 (0.71) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL1366801 0.88 ADAM10 (0.71) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL4638822 0.87 ADAM10 (0.79) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL3648643 0.87 ADAM10 (0.79) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL1366079 0.84 ADAM10 (1.00) ADAM10MMP2ERBB2MMP9MMP3

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
US-8039471-B2 Aza spiro alkane derivatives as inhibitors of metalloproteases INCYTE CORPORATION (US) 2011-10-18 US claimed
US-8039471-B2 Aza spiro alkane derivatives as inhibitors of metalloproteases INCYTE CORPORATION (US) 2011-10-18 US disclosed