SCHEMBL6798384

SCHEMBL6798384

CCCCOC(=O)/C=C/c1ccccn1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.53
APP P05067 5/20 0.52
HCAR2 Q8TDS4 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
TSHR P16473 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KEAP1 Q14145 1/20 0.46
NFE2L2 Q16236 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP2C19 P33261 1/20 0.45
HSP90AA1 P07900 1/20 0.44

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
SCHEMBL6798388 1.00 ATM (0.53) ATMAPPHCAR2L3MBTL1TSHR
SCHEMBL27224520 0.94 APP (0.54) ATMAPPHCAR2TSHRCYP1A2
SCHEMBL22881952 0.91 APP (0.50) ATMAPPHCAR2KEAP1NFE2L2
SCHEMBL22881953 0.86 HSP90AA1 (0.44) ATMKEAP1NFE2L2HSP90AA1
SCHEMBL29550384 0.85 CA12 (0.51) ATMKEAP1NFE2L2HSP90AA1
SCHEMBL2302128 0.85 CA12 (0.51) ATMKEAP1NFE2L2HSP90AA1
SCHEMBL2302901 0.85 CA12 (0.51) ATMKEAP1NFE2L2HSP90AA1
SCHEMBL22881937 0.85 HRH1 (0.43) L3MBTL1TDP1KEAP1NFE2L2CYP1A2
Hydrochloric Acid SCHEMBL28537989 0.84 HSP90AA1 (0.43) ATMKEAP1NFE2L2HSP90AA1
Hydrochloric Acid SCHEMBL29992002 0.84 HSP90AA1 (0.43) ATMKEAP1NFE2L2HSP90AA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025080946-A2 RAS INHIBITORS Revolution Medicines, Inc. (US) 2025-04-17 WO disclosed
US-6784295-B2 CARRIED OUT IN THE PRESENCE OF AN INORGANIC BASE OR ORGANIC NITROGEN BASE AND A PALLADIUM COMPLEX CATALYST CONTAINING SECONDARY MONOPHOSPHINES WITH ALIPHATIC, BRANCHED OR CYCLIC SUBSTITUENTS AS LIGANDS SOLVIAS AG (CH) 2004-08-31 US disclosed
EP-1132361-B1 Coupling of nucleophiles, vinyl compounds or CO with water, alcohols or amines to organic compounds SOLVIAS AG (CH) 2003-05-14 EP disclosed