SCHEMBL30228592

SCHEMBL30228592

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNA3 P22001 1/20 0.40
▸ ALDH1A1 P00352 7/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ IGLV6-57 P01721 6/20 0.38
▸ HPGD P15428 5/20 0.38
▸ GLA P06280 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ CASP7 P55210 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CA12 O43570 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ MEN1 O00255 1/20 0.35

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
SCHEMBL30228313 1.00 KCNA3 (0.40) KCNA3ALDH1A1KDM4ELMNAHTT
SCHEMBL30227885 0.90 KCNA3 (0.42) KCNA3ALDH1A1KDM4ELMNAHTT
SCHEMBL30227894 0.90 KCNA3 (0.42) KCNA3ALDH1A1KDM4ELMNAHTT
SCHEMBL30228403 0.81 KCNA3 (0.46) KCNA3ALDH1A1KDM4ELMNAHTT
SCHEMBL30228433 0.81 KCNA3 (0.46) KCNA3ALDH1A1KDM4ELMNAHTT
SCHEMBL30228168 0.81 KCNA3 (0.43) KCNA3ALDH1A1KDM4ELMNAHTT
SCHEMBL30227861 0.80 TDP1 (0.41) KCNA3ALDH1A1KDM4ELMNAHTT
SCHEMBL30227888 0.80 TDP1 (0.41) KCNA3ALDH1A1KDM4ELMNAHTT
SCHEMBL30228285 0.80 KCNA3 (0.45) KCNA3ALDH1A1KDM4ELMNAHTT
SCHEMBL30228197 0.80 KCNA3 (0.45) KCNA3ALDH1A1KDM4ELMNAHTT

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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