SCHEMBL30457372

SCHEMBL30457372

O=C(Cl)COc1cccc(F)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.54
LMNA P02545 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
KDM4E B2RXH2 1/20 0.49
MAPK1 P28482 1/20 0.49
MRGPRX4 Q96LA9 1/20 0.48
NR4A2 P43354 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
MAOB P27338 1/20 0.47
ENPP2 Q13822 3/20 0.46
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
GPR34 Q9UPC5 1/20 0.44
DAO P14920 1/20 0.44
AHR P35869 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL2718074 1.00 MEN1 (0.54) MEN1KMT2AALDH1A1HPGDLMNA
SCHEMBL4362709 0.87 LMNA (0.56) MEN1KMT2AALDH1A1LMNAKDM4E
SCHEMBL1431527 0.84 LMNA (0.64) MEN1KMT2AALDH1A1HPGDLMNA
SCHEMBL30336996 0.82 MEN1 (0.54) MEN1KMT2AALDH1A1HPGDLMNA
SCHEMBL14783716 0.82 MEN1 (0.54) MEN1KMT2AALDH1A1HPGDLMNA
SCHEMBL9901085 0.82 MAOB (0.54) MEN1KMT2AALDH1A1HPGDLMNA
SCHEMBL15546230 0.81 FFAR1 (0.52) MEN1KMT2AALDH1A1HPGDLMNA
SCHEMBL25271189 0.81 SOD1 (0.44) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL29590819 0.80 WDR5 (0.62) ALDH1A1LMNAKDM4ENR4A2MAOB
SCHEMBL1308577 0.80 WDR5 (0.62) ALDH1A1LMNAKDM4ENR4A2MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4444711-A1 ANTIVIRAL COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-10-16 EP disclosed
WO-2023104882-A1 ANTIVIRAL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-06-15 WO disclosed