SCHEMBL10066820

SCHEMBL10066820

CCC(C)(C)Oc1ccc2cc(Oc3ccc(C(=O)c4ccc(C(C)(CC)CC)c(S(=O)(=O)O)c4)cc3S(=O)(=O)O)ccc2c1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 10/20 0.32
▸ PPARA Q07869 8/20 0.32
▸ CASP1 P29466 1/20 0.31
▸ PPARD Q03181 3/20 0.31
▸ ALDH1A1 P00352 3/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ESRRA P11474 1/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ DUSP3 P51452 1/20 0.31
▸ PTPN5 P54829 1/20 0.31
▸ PTPN11 Q06124 1/20 0.31
▸ CTDSP1 Q9GZU7 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
SCHEMBL14546135 0.93 ALDH1A1 (0.34) PPARGPPARACASP1ALDH1A1SMN1; SMN2
SCHEMBL14364638 0.90 PPARG (0.32) PPARGPPARACASP1PPARDALDH1A1
SCHEMBL14364634 0.86 ELANE (0.33) PPARGPPARAPPARD
SCHEMBL10067135 0.85 NPC1 (0.30) SMN1; SMN2HSD17B10NPC1USP2RAB9A
SCHEMBL10067132 0.85 ALDH1A1 (0.34) PPARGPPARACASP1ALDH1A1SMN1; SMN2
SCHEMBL10066813 0.85 CASP1 (0.36) CASP1ALDH1A1SMN1; SMN2LMNAMAPK1
SCHEMBL13918654 0.83 — —
SCHEMBL14364636 0.83 ALDH1A1 (0.33) PPARGPPARACASP1ALDH1A1SMN1; SMN2
SCHEMBL10066823 0.82 CASP1 (0.35) PPARGPPARACASP1ALDH1A1SMN1; SMN2
SCHEMBL10066818 0.82 CASP1 (0.37) PPARGPPARACASP1ALDH1A1SMN1; SMN2

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-8178590-B2 Block copolymer and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-15 — — US disclosed
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