SCHEMBL8320144

SCHEMBL8320144

CC(C)(C)Oc1ccc(S(OS(C)(=O)=O)(c2ccccc2)c2ccc(OC(C)(C)C)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.39
HSD11B1 P28845 1/20 0.36
HTT P42858 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.36
CYP2C19 P33261 1/20 0.36
ABCB1 P08183 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CNR2 P34972 1/20 0.35
SOS1 Q07889 1/20 0.35
ALDH1A1 P00352 3/20 0.35
MAPT P10636 1/20 0.34
HTR6 P50406 2/20 0.33
MMP2 P08253 1/20 0.33
MMP13 P45452 1/20 0.33
POLB P06746 1/20 0.33
TDP1 Q9NUW8 1/20 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
SCHEMBL8316984 1.00 PPARA (0.39) PPARAHSD11B1HTTSMN1; SMN2LMNA
SCHEMBL8321316 0.93 ELANE (0.36) PPARAHSD11B1SMN1; SMN2CNR2ALDH1A1
SCHEMBL3197600 0.87 TDP1 (0.40) PPARAHSD11B1HTTSMN1; SMN2LMNA
SCHEMBL63999 0.84 HSD11B1 (0.41) PPARAHSD11B1HTTSMN1; SMN2LMNA
SCHEMBL64049 0.84 HSD11B1 (0.41) PPARAHSD11B1HTTSMN1; SMN2LMNA
SCHEMBL8319646 0.84 MEN1 (0.38) PPARAHSD11B1HTTSMN1; SMN2LMNA
SCHEMBL8318837 0.83 ALDH1A1 (0.38) HTTSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL8324855 0.83 ALDH1A1 (0.38) HTTSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL207124 0.82 HTR6 (0.46) SMN1; SMN2LMNAALDH1A1MAPTHTR6
SCHEMBL65270 0.82 HTT (0.45) PPARAHTTSMN1; SMN2LMNACYP2C19

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-5880169-A HAVING HIGH RESOLUTION FOR FINE PATTERNING SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-03-09 US disclosed