SCHEMBL31454504

SCHEMBL31454504

N#CC1(c2cccc(F)c2Br)CC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
NFKB1 P19838 1/20 0.36
RAB9A P51151 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
HDAC4 P56524 3/20 0.34
KMT2A Q03164 1/20 0.31
OPRM1 P35372 1/20 0.31
KDM4E B2RXH2 2/20 0.31
GPR55 Q9Y2T6 2/20 0.31
BDKRB1 P46663 2/20 0.31
PDE7A Q13946 1/20 0.30
CNR1 P21554 1/20 0.30

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
SCHEMBL30929543 0.83 HDAC4 (0.41) ALDH1A1SMN1; SMN2NPC1LMNATP53
SCHEMBL1769351 0.83 HDAC4 (0.41) ALDH1A1SMN1; SMN2NPC1LMNATP53
SCHEMBL3868254 0.81 HDAC4 (0.42) ALDH1A1SMN1; SMN2NPC1LMNATP53
SCHEMBL30183839 0.79 PDE7A (0.31) ALDH1A1HDAC4KDM4EGPR55BDKRB1
SCHEMBL21805029 0.79 PDE7A (0.31) ALDH1A1HDAC4KDM4EGPR55BDKRB1
SCHEMBL3860552 0.77 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2NPC1LMNATP53
SCHEMBL625354 0.76 NPC1 (0.44) ALDH1A1SMN1; SMN2NPC1LMNATP53
SCHEMBL1020368 0.76 NPC1 (0.48) ALDH1A1SMN1; SMN2NPC1LMNATP53
SCHEMBL18742752 0.75 HDAC4 (0.44) ALDH1A1SMN1; SMN2NPC1LMNATP53
SCHEMBL1261041 0.75 KMT2A (0.38) ALDH1A1SMN1; SMN2NPC1LMNATP53

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
CN-119977947-A PRMT5 inhibitor, pharmaceutical composition thereof and application of PRMT5 inhibitor in medicines 广东东阳光药业股份有限公司 2025-05-13 CN disclosed