SCHEMBL30228419

SCHEMBL30228419

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IGLV6-57 P01721 3/20 0.43
▸ KCNA3 P22001 1/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ RAB9A P51151 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ 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

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
SCHEMBL30228143 1.00 IGLV6-57 (0.43) IGLV6-57KCNA3KMT2ARAB9ATDP1
SCHEMBL30228423 0.87 IGLV6-57 (0.45) IGLV6-57KCNA3KMT2ARAB9ATDP1
SCHEMBL30228113 0.87 IGLV6-57 (0.45) IGLV6-57KCNA3KMT2ARAB9ATDP1
SCHEMBL30228289 0.86 IGLV6-57 (0.48) IGLV6-57KCNA3KMT2ARAB9ATDP1
SCHEMBL30227869 0.86 IGLV6-57 (0.44) IGLV6-57KCNA3KMT2ARAB9ATDP1
SCHEMBL30228135 0.86 IGLV6-57 (0.44) IGLV6-57KCNA3KMT2ARAB9ATDP1
SCHEMBL30227937 0.85 IGLV6-57 (0.43) IGLV6-57KCNA3KMT2ARAB9ATDP1
SCHEMBL30228585 0.85 IGLV6-57 (0.43) IGLV6-57KCNA3RAB9ATDP1ALDH1A1
SCHEMBL30228649 0.85 IGLV6-57 (0.43) IGLV6-57KCNA3KMT2ARAB9ATDP1
SCHEMBL30228267 0.85 IGLV6-57 (0.43) IGLV6-57KCNA3KMT2ARAB9ATDP1

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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