SCHEMBL13377578

SCHEMBL13377578

C/C=C/c1c(-c2ccc(OCCC(C)CCCC(C)C)cc2)cc(C)c2ccccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.36
▸ FDPS P14324 2/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ RARB P10826 1/20 0.34
▸ GGPS1 O95749 1/20 0.34
▸ GSTO1 P78417 1/20 0.34
▸ MGAM O43451 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ SI P14410 1/20 0.33
▸ MGAM2 Q2M2H8 1/20 0.33
▸ CHRNB4 P30926 1/20 0.32
▸ CHRNA3 P32297 1/20 0.32
▸ CHRNA7 P36544 1/20 0.32
▸ PTGS1 P23219 1/20 0.32
▸ PDE4A P27815 1/20 0.32
▸ SNCA P37840 1/20 0.32
▸ PDE3A Q14432 1/20 0.32
▸ GPR88 Q9GZN0 1/20 0.31
▸ PDK2 Q15119 1/20 0.31
▸ NPC1 O15118 1/20 0.31

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
SCHEMBL13377588 0.87 ALOX5 (0.32) TDP1FDPSALOX5GAANPC1
SCHEMBL2569098 0.85 TDP1 (0.40) TDP1FDPSALOX5RARBGGPS1
SCHEMBL13377598 0.82 TDP1 (0.36) TDP1FDPSALOX5RARBGGPS1
SCHEMBL13377577 0.77 TP53 (0.39) TDP1FDPSALOX5RARBGGPS1
SCHEMBL13377575 0.76 RARB (0.37) TDP1FDPSALOX5RARBGGPS1
SCHEMBL13377594 0.74 GSTO1 (0.38) TDP1FDPSALOX5RARBGSTO1
SCHEMBL10653441 0.74 FDPS (0.43) TDP1FDPSALOX5RARBGGPS1
SCHEMBL5885700 0.73 FDPS (0.46) TDP1FDPSALOX5RARBGGPS1
SCHEMBL18837357 0.72 NPC1 (0.55) TDP1ALOX5GSTO1NPC1RAB9A
SCHEMBL2569310 0.72 TDP1 (0.38) TDP1FDPSALOX5RARBGGPS1

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
US-7701129-B2 Polymeric fluorescent substance and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-20 — — US disclosed
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