SCHEMBL27355404

SCHEMBL27355404

NCCOCCOc1cc(CC(N)=O)ccc1F

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CXCL12 P48061 2/20 0.38
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CA2 P00918 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
SCHEMBL27355402 0.79 EGFR (0.44) KDM4ECA2
SCHEMBL2821323 0.76 GAA (0.49) CYP4F2CYP4A11KDM4EALDH1A1
SCHEMBL10701749 0.74 PTGER3 (0.53) KDM4EALDH1A1
SCHEMBL30447349 0.74 PTGER3 (0.53) KDM4EALDH1A1
SCHEMBL1115081 0.71 CA2 (0.52) KDM4EALDH1A1CA2
SCHEMBL29718749 0.71 CA2 (0.52) KDM4EALDH1A1CA2
SCHEMBL4149984 0.69 CA2 (0.53) KDM4EALDH1A1CA2
SCHEMBL16929918 0.69 CYP4F2 (0.40) CYP4F2CYP4A11KDM4E
SCHEMBL3690475 0.68 CSNK2A1 (0.41) CYP4F2CYP4A11
SCHEMBL19706678 0.68 ALDH1A1 (0.38) CXCL12CYP4F2CYP4A11KDM4EALDH1A1

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-2024006742-A2 NRF2 PROTEIN DEGRADERS DRACEN PHARMACEUTICALS, INC. (US) 2024-01-04 WO disclosed