SCHEMBL12930335

SCHEMBL12930335

CCCCCCc1csc(-c2sc(-c3sc(-c4sc(-c5sc(-c6sc(C)cc6CCCCCC)cc5CCCCCC)cc4CCCCCC)cc3CCCCCC)cc2CCCCCC)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR35 Q9HC97 1/20 0.34
▸ PTGS2 P35354 4/20 0.33
▸ LTB4R Q15722 5/20 0.33
▸ CYP3A4 P08684 3/20 0.31
▸ TP53 P04637 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALOX5 P09917 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TYR P14679 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ ESR1 P03372 2/20 0.30
▸ ADRA2A P08913 2/20 0.30
▸ ADORA3 P0DMS8 2/20 0.30
▸ TACR2 P21452 2/20 0.30
▸ SLC6A2 P23975 2/20 0.30
▸ SLC6A4 P31645 2/20 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
SCHEMBL16019312 1.00 GPR35 (0.34) GPR35PTGS2LTB4RCYP3A4TP53
SCHEMBL18720387 0.96 GPR35 (0.36) GPR35PTGS2LTB4RCYP3A4TP53
SCHEMBL18352904 0.86 ALOX5 (0.37) GPR35PTGS2LTB4RCYP3A4TP53
SCHEMBL15478096 0.86 GPR35 (0.34) GPR35PTGS2CYP3A4TP53MEN1
SCHEMBL15478097 0.85 GPR35 (0.33) GPR35PTGS2CYP3A4TP53MEN1
SCHEMBL12610457 0.85 GPR35 (0.33) GPR35PTGS2CYP3A4TP53MEN1
SCHEMBL14667889 0.85 GPR35 (0.33) GPR35PTGS2CYP3A4TP53MEN1
SCHEMBL19628241 0.84 PTGS2 (0.34) GPR35PTGS2ALOX5HTR2A
SCHEMBL19614815 0.83 GPR35 (0.34) GPR35PTGS2
SCHEMBL16139796 0.82 GPR35 (0.36) GPR35PTGS2CYP3A4TP53MEN1

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
US-8349903-B2 Dispersant for carbon nanotubes and carbon nanotube composition comprising the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2013-01-08 — — US disclosed
US-20110003907-A1 DISPERSANT FOR CARBON NANOTUBES AND CARBON NANOTUBE COMPOSITION COMPRISING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-01-06 — — US disclosed
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