SCHEMBL12608152

SCHEMBL12608152

CC(C)Oc1ccc(Oc2ccc(S(=O)(=O)c3ccc(C(C)C)cc3)cc2)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 4/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ MAPT P10636 4/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ MCL1 Q07820 2/20 0.42
▸ BRD4 O60885 1/20 0.41
▸ FFAR1 O14842 2/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ HPGD P15428 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39

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
SCHEMBL9915246 0.88 FFAR1 (0.42) HTTSMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL10066695 0.81 LMNA (0.50) HTTSMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL10066817 0.80 MCL1 (0.40) HTTSMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL19557330 0.79 MAPT (0.54) SMN1; SMN2MAPTALDH1A1KDM4ELMNA
SCHEMBL25819149 0.79 LMNA (0.58) HTTSMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL10000942 0.79 LMNA (0.58) HTTSMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL822944 0.78 ALDH1A1 (0.53) HTTSMN1; SMN2ALDH1A1KDM4EMCL1
SCHEMBL822840 0.78 HTT (0.70) HTTSMN1; SMN2MAPTALDH1A1GAA
SCHEMBL13064091 0.78 HTT (0.54) HTTSMN1; SMN2MAPTALDH1A1LMNA
SCHEMBL13668499 0.78 HTT (0.50) HTTSMN1; SMN2MAPTALDH1A1LMNA

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-20110151355-A1 POLYMER, POLYMER ELECTROLYTE AND USE OF SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-23 — — US disclosed
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