SCHEMBL14364636

SCHEMBL14364636

CCC(C)(C)Oc1ccc(-c2ccc(Oc3ccc(C(=O)c4ccc(C(C)(C)C)c(S(=O)(=O)O)c4)cc3S(=O)(=O)O)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ ESRRA P11474 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ POLB P06746 3/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ DUSP3 P51452 1/20 0.33
▸ PTPN5 P54829 1/20 0.33
▸ PTPN11 Q06124 1/20 0.33
▸ CTDSP1 Q9GZU7 1/20 0.33
▸ RARA P10276 2/20 0.33
▸ RARB P10826 2/20 0.33
▸ RARG P13631 2/20 0.33

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
SCHEMBL10066823 0.93 CASP1 (0.35) ALDH1A1SMN1; SMN2KMT2ALMNAMAPK1
SCHEMBL14557892 0.90 ELANE (0.34) ALDH1A1SMN1; SMN2KMT2ALMNAMAPK1
SCHEMBL10066813 0.90 CASP1 (0.36) ALDH1A1SMN1; SMN2KMT2ALMNAMAPK1
SCHEMBL14546135 0.90 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2KMT2ALMNAMAPK1
SCHEMBL14958924 0.86 CASP1 (0.33) POLBCASP1NPC1RAB9A
SCHEMBL13918654 0.86 — —
SCHEMBL13918740 0.86 CASP1 (0.31) POLBCASP1NPC1RAB9A
SCHEMBL13818618 0.84 CASP1 (0.36) ALDH1A1SMN1; SMN2KMT2ALMNAMAPK1
SCHEMBL14958907 0.84 CASP1 (0.30) PPARACASP1
SCHEMBL12834717 0.83 ESRRA (0.36) ALDH1A1SMN1; SMN2ESRRAKMT2ALMNA

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-20070281195-A1 Block copolymer and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED 2007-12-06 — — US disclosed
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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