SCHEMBL24103558

SCHEMBL24103558

Bc1c(O)c(O)c(B)c2c(C(=O)c3ccc(OC)cc3)c(CC)oc12

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SLC22A12 Q96S37 11/20 0.57
▸ CYP2C9 P11712 2/20 0.50
▸ TTR P02766 2/20 0.43
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ CNR2 P34972 1/20 0.39
▸ EYA3 Q99504 2/20 0.39
▸ CYP2C19 P33261 1/20 0.39

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
SCHEMBL24221834 0.90 SLC22A12 (0.57) SLC22A12CYP2C9GAAMAPTHTT
SCHEMBL22680270 0.88 SLC22A12 (0.57) SLC22A12CYP2C9TTRGAAMAPT
SCHEMBL22072514 0.84 SLC22A12 (0.61) SLC22A12CYP2C9TTRGAAMAPT
SCHEMBL22072518 0.81 SLC22A12 (0.60) SLC22A12CYP2C9TTRGAAMAPT
SCHEMBL24103741 0.78 SLC22A12 (0.56) SLC22A12CYP2C9TTREYA3CYP2C19
SCHEMBL24102835 0.74 SLC22A12 (0.51) SLC22A12CYP2C9TTREYA3
SCHEMBL1288098 0.74 SLC22A12 (0.61) SLC22A12CYP2C9MAPTHTTCNR2
SCHEMBL1287522 0.73 SLC22A12 (1.00) SLC22A12CYP2C9TTRMAPTEYA3
SCHEMBL1287630 0.73 SLC22A12 (1.00) SLC22A12CYP2C9TTRGAAMAPT
SCHEMBL1287495 0.72 CYP2C9 (0.60) SLC22A12CYP2C9MAPTHTTCNR2

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-2021252630-A1 METHODS FOR TREATING OR PREVENTING CHRONIC KIDNEY DISEASE ARTHROSI THERAPEUTICS, INC. (US) 2021-12-16 — — WO disclosed
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