SCHEMBL30228113

SCHEMBL30228113

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

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IGLV6-57 P01721 2/20 0.45
▸ KCNA3 P22001 1/20 0.43
▸ ALDH1A1 P00352 6/20 0.39
▸ HPGD P15428 4/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ 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
▸ KDM4E B2RXH2 3/20 0.38
▸ RECQL P46063 2/20 0.38
▸ LMNA P02545 2/20 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
SCHEMBL30228027 0.93 IGLV6-57 (0.40) IGLV6-57KCNA3ALDH1A1HPGDKMT2A
SCHEMBL30228420 0.93 KCNA3 (0.41) IGLV6-57KCNA3ALDH1A1HPGDKMT2A
SCHEMBL30228135 0.91 IGLV6-57 (0.44) IGLV6-57KCNA3ALDH1A1HPGDKMT2A
SCHEMBL30228253 0.90 IGLV6-57 (0.43) IGLV6-57KCNA3ALDH1A1HPGDKMT2A
SCHEMBL30228072 0.89 IGLV6-57 (0.42) IGLV6-57KCNA3ALDH1A1HPGDKMT2A
SCHEMBL30228277 0.89 IGLV6-57 (0.38) IGLV6-57KCNA3ALDH1A1HPGDKMT2A
SCHEMBL30228423 0.88 IGLV6-57 (0.45) IGLV6-57KCNA3ALDH1A1HPGDKMT2A
SCHEMBL30228289 0.88 IGLV6-57 (0.48) IGLV6-57KCNA3ALDH1A1HPGDKMT2A
SCHEMBL30228469 0.88 IGLV6-57 (0.43) IGLV6-57ALDH1A1HPGDKMT2AMEN1
SCHEMBL30228399 0.88 IGLV6-57 (0.43) IGLV6-57ALDH1A1HPGDKMT2AMEN1

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
Send feedback