SCHEMBL30819441

SCHEMBL30819441

CCCCCN(CCCCC)c1ccc(N=Nc2ccc(-c3ccc(N=Nc4ccc(N(CCCC)CCCC)cc4)cc3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.39
MAPT P10636 2/20 0.39
RAB9A P51151 2/20 0.39
KMT2A Q03164 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
EGFR P00533 1/20 0.38
ERBB2 P04626 1/20 0.38
GSK3B P49841 2/20 0.36
AR P10275 1/20 0.36
CNR2 P34972 2/20 0.35
PSMD14 O00487 1/20 0.35
MITF O75030 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35

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
SCHEMBL30590354 1.00 NPC1 (0.39) NPC1MAPTRAB9AKMT2ATDP1
SCHEMBL25392005 0.98 MAPT (0.38) NPC1MAPTRAB9AKMT2ATDP1
SCHEMBL25397302 0.98 TDP1 (0.40) NPC1MAPTRAB9AKMT2ATDP1
SCHEMBL30590319 0.96 TDP1 (0.41) NPC1MAPTRAB9AKMT2ATDP1
SCHEMBL14211447 0.96 TDP1 (0.41) NPC1MAPTRAB9AKMT2ATDP1
SCHEMBL14211451 0.89 MAPT (0.45) NPC1MAPTRAB9AKMT2ATDP1
Benzidine SCHEMBL25393276 0.89 TDP1 (0.46) NPC1MAPTRAB9AKMT2ATDP1
SCHEMBL1128066 0.87 BDKRB2 (0.42) MAPTKMT2AMEN1EGFRERBB2
SCHEMBL25395936 0.87 GLB1 (0.39) NPC1MAPTRAB9AKMT2ATDP1
SCHEMBL16791896 0.86 ALDH1A1 (0.52) NPC1MAPTRAB9AKMT2ATDP1

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
CN-117826306-A Low-haze film polarizer and preparation method thereof 香港科技大学 2024-04-05 CN disclosed
CN-117820873-A Bis-azo biphenyl dye, polarizer comprising same, and preparation method of bis-azo biphenyl dye 香港科技大学 2024-04-05 CN disclosed