SCHEMBL31662347

SCHEMBL31662347

COC(=O)c1cc(Oc2ccc(O)c(F)c2)c2c(cnn2C)c1.COC(=O)c1cc(Oc2ccc(O)c(F)c2)c2c(cnn2C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.38
PTPN11 Q06124 2/20 0.38
KDM4E B2RXH2 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
APEX1 P27695 1/20 0.38
CASP1 P29466 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
CASP7 P55210 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SCN9A Q15858 5/20 0.38
USP2 O75604 1/20 0.36

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
SCHEMBL31662404 0.87 SCN9A (0.40) LMNAPTPN11KDM4ETDP1MEN1
SCHEMBL31662519 0.85 CA12 (0.41) LMNAPTPN11KDM4ETDP1MEN1
SCHEMBL31662290 0.82 USP2 (0.39) LMNAPTPN11KDM4EALDH1A1KMT2A
SCHEMBL31662084 0.82 MAOB (0.36) LMNAPTPN11KDM4ETDP1MAPT
SCHEMBL31662635 0.79 SCN9A (0.48) SCN9AMAOBCYP11B1CYP11B2CA12
SCHEMBL31662527 0.78 MAPT (0.41) LMNAKDM4ETDP1MEN1ALDH1A1
SCHEMBL31662315 0.78 MAPT (0.41) LMNAKDM4ETDP1MEN1ALDH1A1
SCHEMBL31662593 0.77 PPARG (0.40) SCN9ACA12CA1CA2CA9
SCHEMBL31662488 0.77 LMNA (0.37) LMNAMAPTSCN9AUSP2GAA
SCHEMBL31662262 0.76 LMNA (0.46) LMNAMEN1MAPTHPGDKMT2A

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-2025149545-A1 HETEROARYLPHENYL ETHER DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-07-17 WO disclosed