Satigrel

Satigrel

SCHEMBL9050447

COc1ccc(C(=C(C#N)CCC(=O)O)c2ccc(OC)cc2)cc1.[NaH]

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.53
ALDH1A1 P00352 1/20 0.49
CYP1A2 P05177 1/20 0.49
HPGD P15428 1/20 0.49
CYP2C19 P33261 1/20 0.49
HSD17B10 Q99714 1/20 0.49
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
CES2 O00748 2/20 0.47
CES1 P23141 2/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
HTT P42858 2/20 0.46
NPSR1 Q6W5P4 1/20 0.44
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
MAPT P10636 1/20 0.43
GSK3B P49841 1/20 0.42

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
Satigrel SCHEMBL379555 0.98 PDE4B (0.54) PDE4BALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL9549165 0.93 PDE4B (0.49) PDE4BALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL9549159 0.93 PDE4B (0.49) PDE4BALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL9549180 0.93 PDE4B (0.49) PDE4BALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL9549204 0.91 PDE4B (0.61) PDE4BALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL9549325 0.90 ALDH1A1 (0.49) PDE4BALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL9549320 0.90 ALDH1A1 (0.49) PDE4BALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL9549067 0.86 CA1 (0.49) PDE4BALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL9549213 0.84 PDE4B (0.53) PDE4BALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL9549205 0.84 PDE4B (0.53) PDE4BALDH1A1CYP1A2HPGDCYP2C19

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
JP-8268886-A None JP disclosed
JP-H08268886-A SUPPRESSING AGENT FOR VASCULARIZATION EISAI CO LTD 1996-10-15 JP disclosed