SCHEMBL6671910

SCHEMBL6671910

CCCOC(=O)C(NC(=O)OC(C)(C)C)C(C)(C)c1cc(F)c2ncc(C(=O)NCc3ccc(Cl)cc3)c(O)c2c1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 3/20 0.36
GAA P10253 1/20 0.36
LMNA P02545 2/20 0.36
NR3C1 P04150 1/20 0.36
EGLN1 Q9GZT9 1/20 0.35
MAPT P10636 3/20 0.34
POLB P06746 1/20 0.34
ACVR1B P36896 1/20 0.34
TGFBR1 P36897 1/20 0.34
ACVRL1 P37023 1/20 0.34
RECQL P46063 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
S1PR3 Q99500 1/20 0.34
THRB P10828 1/20 0.34
CNR2 P34972 3/20 0.33
CNR1 P21554 1/20 0.33
EPHX2 P34913 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
SCHEMBL6666974 0.86 LMNA (0.39) LMNANR3C1EGLN1MAPTPOLB
SCHEMBL6667062 0.81 POLB (0.37) P2RX3GAALMNANR3C1MAPT
SCHEMBL6201678 0.81 GAA (0.37) P2RX3GAALMNANR3C1EGLN1
SCHEMBL6201682 0.80 GAA (0.36) P2RX3GAALMNANR3C1EGLN1
SCHEMBL6195418 0.79 TRPA1 (0.39) P2RX3GAALMNANR3C1EGLN1
SCHEMBL6197930 0.77 POLB (0.45) GAAMAPTPOLBNPSR1
SCHEMBL6198141 0.76 EGLN1 (0.47) GAALMNANR3C1EGLN1MAPT
SCHEMBL6197986 0.75 EGLN1 (0.49) LMNANR3C1EGLN1NPSR1CNR2
SCHEMBL6672976 0.75 LMNA (0.38) GAALMNANR3C1EGLN1MAPT
SCHEMBL6672498 0.74 SLC2A1 (0.39) NR3C1EGLN1CNR2

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
WO-2004019932-A1 METHOD OF PREVENTING OR TREATING ATHEROSCLEROSIS OR RESTENOSIS PHARMACIA & UPJOHN COMPANY (US) 2004-03-11 WO claimed
WO-2004019932-A1 METHOD OF PREVENTING OR TREATING ATHEROSCLEROSIS OR RESTENOSIS PHARMACIA & UPJOHN COMPANY (US) 2004-03-11 WO disclosed