SCHEMBL23258495

SCHEMBL23258495

CC(C)(C)OC(=O)Oc1cc(C2=CC3CCC(C2)O3)cccc1=O

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 2/20 0.45
▸ SLC6A4 P31645 2/20 0.31

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
SCHEMBL23258502 0.78 KDM1A (0.32) —
SCHEMBL23258498 0.74 SLC6A4 (0.35) SLC6A3SLC6A4
SCHEMBL23258797 0.73 FABP7 (0.43) —
SCHEMBL23263355 0.73 CLK4 (0.40) —
SCHEMBL23263154 0.71 DHFR (0.36) —
SCHEMBL23263340 0.70 KIF11 (0.43) —
SCHEMBL23263865 0.69 ABL1 (0.37) —
SCHEMBL23259212 0.69 CYP3A4 (0.44) —
SCHEMBL27018362 0.69 ELANE (0.35) —
SCHEMBL23249868 0.68 ELANE (0.41) —

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-2021076938-A1 TROPOLONE DERIVATIVES AND TAUTOMERS THEREOF FOR IRON REGULATION IN ANIMALS Ambys Medicines, Inc. (US) 2021-04-22 — — WO disclosed
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