SCHEMBL30228036

SCHEMBL30228036

Cc1ccccc1-c1cc(=O)oc2cc(N(C)[C@@H](C)C(=O)NCC(N)=O)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNA3 P22001 1/20 0.41
▸ IGLV6-57 P01721 5/20 0.39
▸ ALDH1A1 P00352 4/20 0.37
▸ HPGD P15428 3/20 0.37
▸ GLA P06280 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ CASP1 P29466 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ KMT2A Q03164 1/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ CA12 O43570 2/20 0.36

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
SCHEMBL30228257 1.00 KCNA3 (0.41) KCNA3IGLV6-57ALDH1A1HPGDGLA
SCHEMBL30228403 0.87 KCNA3 (0.46) KCNA3IGLV6-57ALDH1A1HPGDGLA
SCHEMBL30228433 0.87 KCNA3 (0.46) KCNA3IGLV6-57ALDH1A1HPGDGLA
SCHEMBL30228175 0.84 KCNA3 (0.47) KCNA3IGLV6-57ALDH1A1HPGDGLA
SCHEMBL30228263 0.84 KCNA3 (0.47) KCNA3IGLV6-57ALDH1A1HPGDGLA
SCHEMBL30227869 0.84 IGLV6-57 (0.44) KCNA3IGLV6-57ALDH1A1HPGDGLA
SCHEMBL30228131 0.80 IGLV6-57 (0.50) KCNA3IGLV6-57ALDH1A1HPGDGLA
SCHEMBL30228311 0.79 IGLV6-57 (0.45) KCNA3IGLV6-57ALDH1A1HPGDGLA
SCHEMBL30227929 0.79 IGLV6-57 (0.45) KCNA3IGLV6-57ALDH1A1HPGDGLA
SCHEMBL30228142 0.79 IGLV6-57 (0.45) KCNA3IGLV6-57ALDH1A1HPGDGLA

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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