SCHEMBL31504183

SCHEMBL31504183

COc1ccc(C(=O)Nc2ccc(N3CCN(c4ccccn4)CC3)cc2)c(F)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.54
MAPT P10636 6/20 0.52
NPC1 O15118 4/20 0.52
RAB9A P51151 4/20 0.52
TSHR P16473 2/20 0.52
MAPK1 P28482 2/20 0.52
TP53 P04637 2/20 0.52
KMT2A Q03164 2/20 0.52
NAMPT P43490 1/20 0.52
SMN1; SMN2 Q16637 5/20 0.51
USP2 O75604 1/20 0.51
ALDH1A1 P00352 5/20 0.50
MCL1 Q07820 1/20 0.50
MEN1 O00255 1/20 0.50
HCRTR1 O43613 1/20 0.50
HTR1A P08908 1/20 0.48
HTR2A P28223 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HTT P42858 1/20 0.48
QSOX1 O00391 1/20 0.48

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
SCHEMBL22495244 1.00 LMNA (0.54) LMNAMAPTNPC1RAB9ATSHR
SCHEMBL30172104 0.94 MAPT (0.49) LMNAMAPTNPC1RAB9ATSHR
SCHEMBL22574512 0.93 MAPT (0.52) LMNAMAPTNPC1RAB9ATSHR
SCHEMBL22495453 0.90 DGAT1 (0.53) LMNAMAPTNPC1RAB9ATSHR
SCHEMBL31504192 0.90 DGAT1 (0.53) LMNAMAPTNPC1RAB9ATSHR
SCHEMBL22495261 0.89 NAMPT (0.55) LMNAMAPTNPC1RAB9ATSHR
SCHEMBL31504234 0.89 NAMPT (0.55) LMNAMAPTNPC1RAB9ATSHR
SCHEMBL31504250 0.88 DRD4 (0.46) LMNAMAPTNPC1RAB9ATSHR
SCHEMBL22495258 0.88 DRD4 (0.46) LMNAMAPTNPC1RAB9ATSHR
SCHEMBL22495336 0.88 ALDH1A1 (0.51) LMNAMAPTNPC1RAB9ATSHR

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
EP-3728234-B1 RADIOLABELED COMPOUNDS HOFFMANN LA ROCHE (CH) 2025-05-14 EP claimed