SCHEMBL12608154

SCHEMBL12608154

CCCC(C)(C)Oc1cccc2c(Oc3ccc(S(=O)(=O)c4ccc(C(C)(C)CCC)cc4)cc3)cccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 2/20 0.39
▸ HTT P42858 3/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HSD11B1 P28845 1/20 0.33
▸ PTPN1 P18031 1/20 0.32
▸ ELANE P08246 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ RXFP1 Q9HBX9 2/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ LMNA P02545 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
SCHEMBL12606797 0.87 MCL1 (0.41) MCL1HTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL13329235 0.86 HTT (0.40) MCL1HTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL12464121 0.84 ELANE (0.41) MCL1L3MBTL1CASP1NPC1RAB9A
SCHEMBL13243767 0.83 HSD11B1 (0.37) MCL1HTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL13181443 0.82 MCL1 (0.45) MCL1HTTSMN1; SMN2CASP1NPC1
SCHEMBL13602257 0.81 HTT (0.43) MCL1HTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL14364714 0.77 HTT (0.38) MCL1HTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL13602275 0.77 MCL1 (0.35) MCL1HTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL13266249 0.76 MCL1 (0.35) MCL1HTTSMN1; SMN2TDP1POLB
SCHEMBL12831322 0.74 HTT (0.39) MCL1HTTSMN1; SMN2NPC1RAB9A

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-20110151355-A1 POLYMER, POLYMER ELECTROLYTE AND USE OF SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-23 — — US disclosed
US-20090117438-A1 POLYMER ELECTROLYTE, AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE-ELECTRODE ASSEMBLY AND FUEL CELL THAT ARE USING THE POLYMER ELECTROLYTE SUMITOMO CHEMICAL COMPANY , LIMITED (JP) 2009-05-07 — — US disclosed
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