SCHEMBL23745399

SCHEMBL23745399

C=C(C)C(C)NC(=O)CC[C@@]1(C2CC2)NC(=O)NC1=O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 19/20 0.43
▸ ADAM17 P78536 3/20 0.42
▸ MMP2 P08253 5/20 0.41
▸ ADAMTS4 O75173 2/20 0.40
▸ MMP3 P08254 2/20 0.40
▸ MMP12 P39900 2/20 0.40
▸ MMP13 P45452 2/20 0.40
▸ MMP14 P50281 2/20 0.40
▸ MMP9 P14780 1/20 0.40
▸ MMP8 P22894 1/20 0.40

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
SCHEMBL17871205 0.76 ADAMTS5 (0.56) ADAMTS5ADAM17MMP2ADAMTS4MMP13
SCHEMBL17884864 0.67 ADAMTS5 (0.59) ADAMTS5ADAM17MMP2ADAMTS4MMP3
SCHEMBL17884468 0.67 ADAMTS5 (0.59) ADAMTS5ADAM17MMP2ADAMTS4MMP3
SCHEMBL17884471 0.67 ADAMTS5 (0.59) ADAMTS5ADAM17MMP2ADAMTS4MMP3
SCHEMBL23745375 0.67 ADAMTS5 (0.59) ADAMTS5ADAM17MMP2ADAMTS4MMP3
SCHEMBL23745377 0.67 ADAMTS5 (0.59) ADAMTS5ADAM17MMP2ADAMTS4MMP3
SCHEMBL24182506 0.64 ADAMTS7 (0.51) ADAMTS5MMP2ADAMTS4MMP3MMP12
SCHEMBL23366977 0.64 ADAMTS7 (0.51) ADAMTS5MMP2ADAMTS4MMP3MMP12
SCHEMBL23354017 0.64 ADAMTS7 (0.61) ADAMTS5MMP2ADAMTS4MMP3MMP12
SCHEMBL23354182 0.64 ADAMTS7 (0.61) ADAMTS5MMP2ADAMTS4MMP3MMP12

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-2021158626-A1 ADAMTS INHIBITORS, PREPARATION METHODS AND MEDICINAL USES THEREOF Eternity Bioscience Inc. (US) 2021-08-12 — — WO disclosed
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