SCHEMBL23745414

SCHEMBL23745414

C[C@@H]1c2ccccc2CN1C(=O)CC[C@@]1(C2CC2)NC(=O)NC1=O

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 18/20 0.55
▸ MMP2 P08253 5/20 0.55
▸ ADAMTS4 O75173 3/20 0.49
▸ ADAM17 P78536 1/20 0.49
▸ MMP13 P45452 1/20 0.48
▸ ADAMTS1 Q9UHI8 1/20 0.48

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
SCHEMBL23745422 1.00 ADAMTS5 (0.55) ADAMTS5MMP2ADAMTS4ADAM17MMP13
SCHEMBL29835174 0.84 ADAMTS5 (0.54) ADAMTS5MMP2ADAMTS4ADAM17MMP13
SCHEMBL29835131 0.84 ADAMTS5 (0.54) ADAMTS5MMP2ADAMTS4ADAM17MMP13
SCHEMBL29250239 0.84 ADAMTS5 (0.54) ADAMTS5MMP2ADAMTS4ADAM17MMP13
SCHEMBL23745336 0.84 ADAMTS5 (0.54) ADAMTS5MMP2ADAMTS4ADAM17MMP13
SCHEMBL29250240 0.84 ADAMTS5 (0.54) ADAMTS5MMP2ADAMTS4ADAM17MMP13
SCHEMBL23745213 0.84 ADAMTS5 (0.54) ADAMTS5MMP2ADAMTS4ADAM17MMP13
SCHEMBL23745335 0.84 ADAMTS5 (0.54) ADAMTS5MMP2ADAMTS4ADAM17MMP13
SCHEMBL29835144 0.84 ADAMTS5 (0.54) ADAMTS5MMP2ADAMTS4ADAM17MMP13
SCHEMBL31121194 0.81 ADAMTS5 (0.69) ADAMTS5MMP2ADAMTS4ADAM17MMP13

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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