SCHEMBL23745265

SCHEMBL23745265

O=C1NC(=O)C(CCC(=O)N2Cc3cc(Cl)c(C(F)(F)F)cc3C2)(c2cnccn2)N1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 20/20 0.55
▸ ADAM17 P78536 12/20 0.55
▸ MMP2 P08253 10/20 0.54
▸ MMP14 P50281 2/20 0.50
▸ MMP13 P45452 4/20 0.46
▸ ADAMTS1 Q9UHI8 1/20 0.46
▸ ADAMTS4 O75173 1/20 0.43

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
SCHEMBL23745266 1.00 ADAMTS5 (0.55) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL23745267 1.00 ADAMTS5 (0.55) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL23745272 0.88 ADAMTS5 (0.61) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL23745246 0.88 ADAMTS5 (0.61) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL23745245 0.88 ADAMTS5 (0.61) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL23727805 0.86 ADAMTS5 (0.62) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL29835124 0.86 ADAMTS5 (0.62) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL23727492 0.86 ADAMTS5 (0.52) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL23745275 0.83 ADAMTS5 (0.41) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL23745274 0.83 ADAMTS5 (0.41) ADAMTS5ADAM17MMP2MMP14MMP13

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 4 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
EP-4100005-A1 ADAMTS INHIBITORS, PREPARATION METHODS AND MEDICINAL USES THEREOF Jiangsu Hengrui Pharmaceuticals Co., Ltd. (CN) 2022-12-14 — — EP 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
WO-2021158626-A1 ADAMTS INHIBITORS, PREPARATION METHODS AND MEDICINAL USES THEREOF Eternity Bioscience Inc. (US) 2021-08-12 — — WO disclosed
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