SCHEMBL30228317

SCHEMBL30228317

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNA3 P22001 3/20 0.47
▸ IGLV6-57 P01721 2/20 0.44
▸ ALDH1A1 P00352 4/20 0.42
▸ HPGD P15428 3/20 0.42
▸ CA9 Q16790 4/20 0.41
▸ CA12 O43570 3/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA5A P35218 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ AR P10275 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ ALDH2 P05091 1/20 0.38
▸ AKR1B1 P15121 1/20 0.38
▸ MAOA P21397 1/20 0.38
▸ MAOB P27338 1/20 0.38

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
SCHEMBL30228319 1.00 KCNA3 (0.47) KCNA3IGLV6-57ALDH1A1HPGDCA9
SCHEMBL30227976 0.90 KCNA3 (0.48) KCNA3IGLV6-57ALDH1A1HPGDCA9
SCHEMBL30228324 0.87 ALDH1A1 (0.49) KCNA3IGLV6-57ALDH1A1HPGDCA9
SCHEMBL30228296 0.87 KCNA3 (0.46) KCNA3IGLV6-57ALDH1A1HPGDCA9
SCHEMBL30228192 0.87 KCNA3 (0.46) KCNA3IGLV6-57ALDH1A1HPGDCA9
SCHEMBL30228214 0.84 KCNA3 (0.43) KCNA3IGLV6-57ALDH1A1HPGDCA9
SCHEMBL30227927 0.83 HSD17B10 (0.42) KCNA3IGLV6-57ALDH1A1HPGDKDM4E
SCHEMBL30228381 0.82 KCNA3 (0.56) KCNA3ALDH1A1HPGDCA9CA12
Hydrochloric Acid SCHEMBL30228355 0.81 KCNA3 (0.55) KCNA3ALDH1A1HPGDCA9CA12
SCHEMBL31710481 0.80 KCNA3 (0.52) KCNA3IGLV6-57ALDH1A1HPGDCA9

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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