SCHEMBL23745303

SCHEMBL23745303

COC[C@]1(CCC(=O)N2Cc3ccc(C(F)(F)F)cc3C2)NC(O)NC1=O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 1/20 0.40
▸ DPP7 Q9UHL4 2/20 0.39
▸ ADAMTS5 Q9UNA0 3/20 0.37
▸ ADAM17 P78536 2/20 0.37
▸ MMP2 P08253 1/20 0.37
▸ NAMPT P43490 3/20 0.36
▸ DPP4 P27487 2/20 0.36
▸ CCR2 P41597 5/20 0.35
▸ KCNH2 Q12809 1/20 0.34
▸ SLC6A9 P48067 1/20 0.34

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
SCHEMBL23745387 1.00 FAP (0.40) FAPDPP7ADAMTS5ADAM17MMP2
SCHEMBL29835177 0.84 ADAMTS5 (0.54) DPP7ADAMTS5ADAM17MMP2
SCHEMBL31121188 0.84 ADAMTS5 (0.54) DPP7ADAMTS5ADAM17MMP2
SCHEMBL23745304 0.84 ADAMTS5 (0.54) DPP7ADAMTS5ADAM17MMP2
SCHEMBL23745243 0.84 ADAMTS5 (0.54) DPP7ADAMTS5ADAM17MMP2
SCHEMBL31121195 0.84 ADAMTS5 (0.54) DPP7ADAMTS5ADAM17MMP2
SCHEMBL23728091 0.84 ADAMTS5 (0.54) DPP7ADAMTS5ADAM17MMP2
SCHEMBL30013242 0.75 DPP7 (0.41) FAPDPP7NAMPTDPP4CCR2
SCHEMBL30013203 0.75 DPP7 (0.41) FAPDPP7NAMPTDPP4CCR2
SCHEMBL23745323 0.72 DPP7 (0.49) FAPDPP7NAMPTDPP4KCNH2

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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