SCHEMBL23727513

SCHEMBL23727513

CC(CC1NC(=O)NC1=O)C(=O)N1Cc2cc(Cl)c(Cl)cc2C1C

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 14/20 0.53
▸ ADAM17 P78536 6/20 0.53
▸ MMP2 P08253 3/20 0.53
▸ MMP14 P50281 1/20 0.49
▸ ADAM10 O14672 1/20 0.34
▸ ADAMTS4 O75173 1/20 0.34
▸ MMP12 P39900 1/20 0.34
▸ ADAM9 Q13443 1/20 0.34
▸ SLC18A2 Q05940 1/20 0.34
▸ MMP13 P45452 1/20 0.30
▸ ACE P12821 1/20 0.30

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
SCHEMBL30012305 0.80 MMP2 (0.32) ADAMTS5ADAM17MMP2MMP14ACE
SCHEMBL29835171 0.74 ADAMTS5 (0.55) ADAMTS5ADAM17MMP2MMP14ADAMTS4
SCHEMBL23745343 0.74 ADAMTS5 (0.55) ADAMTS5ADAM17MMP2MMP14ADAMTS4
SCHEMBL23745290 0.72 ADAMTS5 (0.45) ADAMTS5ADAM17ADAM10ADAMTS4MMP12
SCHEMBL17871566 0.69 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP14ADAM10
SCHEMBL17884949 0.68 ADAMTS5 (0.49) ADAMTS5ADAM17MMP2MMP14ADAMTS4
SCHEMBL22063167 0.67 ADAMTS5 (0.74) ADAMTS5ADAM17MMP2MMP14ADAM10
SCHEMBL23745474 0.67 HSP90AA1 (0.30) —
SCHEMBL20708354 0.66 ADAMTS5 (0.77) ADAMTS5ADAM17MMP2MMP14ADAM10
SCHEMBL30013124 0.66 ADAMTS5 (0.54) ADAMTS5ADAM17MMP2MMP14

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
EP-4100005-A1 ADAMTS INHIBITORS, PREPARATION METHODS AND MEDICINAL USES THEREOF Jiangsu Hengrui Pharmaceuticals Co., Ltd. (CN) 2022-12-14 — — EP 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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