SCHEMBL30228596

SCHEMBL30228596

Cc1ccccc1-c1cc(=O)oc2cc(N(C)CC(=O)OC(C)(C)C)ccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IGLV6-57 P01721 5/20 0.46
▸ KCNA3 P22001 1/20 0.43
▸ CA12 O43570 3/20 0.41
▸ CA9 Q16790 3/20 0.41
▸ CA1 P00915 1/20 0.41
▸ ALDH1A1 P00352 9/20 0.40
▸ HPGD P15428 7/20 0.40
▸ USP2 O75604 1/20 0.40
▸ LMNA P02545 4/20 0.39
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ NCOA1 Q15788 1/20 0.39
▸ NCOA3 Q9Y6Q9 1/20 0.39
▸ GLA P06280 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CASP1 P29466 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
SCHEMBL30228322 0.91 ALDH1A1 (0.42) IGLV6-57KCNA3CA12CA9CA1
SCHEMBL30228149 0.89 IGLV6-57 (0.48) IGLV6-57KCNA3CA12CA9ALDH1A1
SCHEMBL30227912 0.88 IGLV6-57 (0.50) IGLV6-57KCNA3CA12CA9ALDH1A1
SCHEMBL30228182 0.86 IGLV6-57 (0.46) IGLV6-57KCNA3CA12CA9ALDH1A1
SCHEMBL30227938 0.85 IGLV6-57 (0.51) IGLV6-57KCNA3CA12CA9CA1
SCHEMBL30228131 0.84 IGLV6-57 (0.50) IGLV6-57KCNA3CA12CA9ALDH1A1
SCHEMBL30228289 0.82 IGLV6-57 (0.48) IGLV6-57KCNA3CA12CA9ALDH1A1
SCHEMBL30228261 0.82 IGLV6-57 (0.47) IGLV6-57KCNA3CA12CA9ALDH1A1
SCHEMBL30228326 0.81 KCNA3 (0.45) IGLV6-57KCNA3CA12CA9CA1
SCHEMBL30228154 0.81 IGLV6-57 (0.46) IGLV6-57KCNA3CA12CA9ALDH1A1

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-2023034346-A1 CHROMEN-2-ONE MODULATORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2023-03-09 — — WO disclosed
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