SCHEMBL14546136

SCHEMBL14546136

CCC(C)(C)c1ccc(S(=O)(=O)c2ccc(Oc3ccc(OC(C)(C)C)cc3)c(S(=O)(=O)O)c2)cc1S(=O)(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP1 P29466 1/20 0.36
▸ POLB P06746 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ DUSP3 P51452 1/20 0.35
▸ PTPN5 P54829 1/20 0.35
▸ PTPN11 Q06124 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ CTDSP1 Q9GZU7 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ RXFP1 Q9HBX9 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ TBXA2R P21731 10/20 0.34
▸ PKM P14618 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ RRM1 P23921 1/20 0.34

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
SCHEMBL13181479 0.92 CASP1 (0.35) CASP1POLBKDM4EL3MBTL1ALDH1A1
SCHEMBL13181442 0.91 ELANE (0.39) POLBL3MBTL1ALDH1A1MAPTCTDSP1
SCHEMBL14546134 0.89 CASP1 (0.34) CASP1POLBKDM4EL3MBTL1ALDH1A1
SCHEMBL12807621 0.87 RRM1 (0.34) CASP1POLBKDM4EL3MBTL1ALDH1A1
SCHEMBL10067129 0.87 CASP1 (0.36) CASP1POLBKDM4EL3MBTL1ALDH1A1
SCHEMBL13918913 0.86 RRM1 (0.33) RRM1
SCHEMBL13918744 0.86 RRM1 (0.32) RRM1
SCHEMBL20375312 0.85 POLB (0.35) POLBKDM4EL3MBTL1ALDH1A1MAPT
SCHEMBL19359711 0.85 MEN1 (0.35) ALDH1A1SMN1; SMN2RRM1MEN1KMT2A
SCHEMBL14545946 0.84 HSD11B1 (0.34) CASP1POLBKDM4EL3MBTL1ALDH1A1

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-20070083010-A1 aromatic polyether with sulfonic acid-functional block and acid-free blocks; polyether sulfones; polymer electrolyte fuel cells SUMITOMO CHEMICAL COMPANY, LIMITED 2007-04-12 — — US disclosed
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