SCHEMBL11348391

SCHEMBL11348391

CCCCC(CC)CNCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 2/20 0.51
ALDH1A1 P00352 7/20 0.47
TSHR P16473 5/20 0.47
CYP3A4 P08684 3/20 0.47
KDM4E B2RXH2 2/20 0.43
SCN2A Q99250 2/20 0.43
HTT P42858 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
GLA P06280 1/20 0.40
GAA P10253 5/20 0.39
KMT2A Q03164 3/20 0.39
ATM Q13315 3/20 0.39
NPSR1 Q6W5P4 3/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
CYP1A2 P05177 2/20 0.39
MAPK1 P28482 2/20 0.39
BLM P54132 2/20 0.39
HIF1A Q16665 2/20 0.39
USP2 O75604 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
SCHEMBL888619 0.81 HMGCR (0.47) GSRALDH1A1TSHRCYP3A4KDM4E
SCHEMBL11342390 0.81 TSHR (0.42) GSRALDH1A1TSHRCYP3A4KDM4E
SCHEMBL14174524 0.78 GAA (0.64) ALDH1A1TSHRHTTL3MBTL1GLA
SCHEMBL11682066 0.78 GSR (0.40) GSRALDH1A1TSHRCYP3A4KDM4E
SCHEMBL16270988 0.77 GAA (0.48) GSRALDH1A1TSHRCYP3A4KDM4E
SCHEMBL11808400 0.76 TSHR (0.55) TSHRHTTL3MBTL1GLAGAA
SCHEMBL2679600 0.76 CYP3A4 (0.40) ALDH1A1TSHRCYP3A4KDM4EL3MBTL1
SCHEMBL28300402 0.76 ALDH1A1 (0.55) ALDH1A1TSHRCYP3A4KDM4EHTT
SCHEMBL19627028 0.76 GSR (0.67) GSRALDH1A1TSHRCYP3A4SCN2A
SCHEMBL5573148 0.76 GSR (0.67) GSRALDH1A1TSHRCYP3A4SCN2A

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-4278577-A HEAT RESISTANCE AMERICAN CYANAMID COMPANY (US) 1981-07-14 US disclosed
EP-0029090-A2 Sulfon amides containing a hindered phenol; stabilized composition containing a synthetic polymer and said sulfon amides AMERICAN CYANAMID COMPANY (US) 1981-05-27 EP disclosed