SCHEMBL29250257

SCHEMBL29250257

O=C1NC(=O)C(CCC(=O)N2Cc3ccc(C(F)(F)F)cc3C2)(C2CC2)N1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 19/20 0.55
▸ MMP13 P45452 3/20 0.55
▸ ADAM17 P78536 2/20 0.53
▸ MMP2 P08253 4/20 0.52
▸ ADAMTS4 O75173 2/20 0.52
▸ ADAMTS1 Q9UHI8 1/20 0.52

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
SCHEMBL29835134 1.00 ADAMTS5 (0.55) ADAMTS5MMP13ADAM17MMP2ADAMTS4
SCHEMBL23745214 1.00 ADAMTS5 (0.55) ADAMTS5MMP13ADAM17MMP2ADAMTS4
SCHEMBL29835185 0.92 ADAMTS5 (0.54) ADAMTS5MMP13ADAM17MMP2ADAMTS4
SCHEMBL29835157 0.92 ADAMTS5 (0.54) ADAMTS5MMP13ADAM17MMP2ADAMTS4
SCHEMBL23745405 0.92 ADAMTS5 (0.54) ADAMTS5MMP13ADAM17MMP2ADAMTS4
SCHEMBL29250233 0.92 ADAMTS5 (0.54) ADAMTS5MMP13ADAM17MMP2ADAMTS4
SCHEMBL23727481 0.88 ADAMTS5 (0.58) ADAMTS5MMP13ADAM17MMP2ADAMTS4
SCHEMBL23727483 0.88 ADAMTS5 (0.58) ADAMTS5MMP13ADAM17MMP2ADAMTS4
SCHEMBL23745412 0.86 ADAMTS5 (0.65) ADAMTS5MMP13ADAM17MMP2ADAMTS4
SCHEMBL23745206 0.86 ADAMTS5 (0.53) ADAMTS5MMP13ADAM17MMP2ADAMTS4

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
CN-115052596-B ADAMTS inhibitor, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2024-06-14 — — CN disclosed
CN-115052596-A ADAMTS inhibitor, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2022-09-13 — — CN disclosed
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