SCHEMBL7640906

SCHEMBL7640906

COC(=O)C(C)(NC(=O)C(C)c1ccc(OC)cc1)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
GAA P10253 1/20 0.43
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
RAB9A P51151 1/20 0.42
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
PPARG P37231 1/20 0.41
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
CXCR2 P25025 1/20 0.39
PTGS2 P35354 3/20 0.39
PTGS1 P23219 2/20 0.39
AKR1C3 P42330 2/20 0.39
AKR1C2 P52895 2/20 0.39
CDC42 P60953 1/20 0.39
RAC1 P63000 1/20 0.39
CYP1A2 P05177 1/20 0.39
TSHR P16473 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
SCHEMBL7960750 0.87 GPR88 (0.46) GPR88NPSR1GAAKMT2AMEN1
SCHEMBL7671511 0.86 CXCR2 (0.38) GPR88CXCR2ACACB
SCHEMBL7641154 0.86 SMN1; SMN2 (0.39) KMT2AMEN1RAB9ACXCR2CYP1A2
SCHEMBL7639480 0.86 GRM7 (0.46) MAPTCXCR2
SCHEMBL7638122 0.86 FFAR2 (0.42) KMT2AMEN1CYP3A4CXCR2CYP1A2
SCHEMBL7960898 0.85 GPR88 (0.49) GPR88NPSR1GAAKMT2AMEN1
SCHEMBL7964623 0.80 GPR88 (0.50) GPR88NPSR1GAAKMT2AMEN1
SCHEMBL7958013 0.79 GPR88 (0.52) GPR88NPSR1GAAKMT2AMEN1
SCHEMBL7961960 0.79 GPR88 (0.49) GPR88NPSR1GAAKMT2AOPRM1
SCHEMBL7961964 0.79 GPR88 (0.46) GPR88NPSR1GAAKMT2AMEN1

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-6469210-B1 EXCELLENT FUNGICIDAL ACTIVITY IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2002-10-22 US disclosed
EP-1092706-A1 PROCESS FOR THE PREPARATION OF PHENYLALKANOIC ACID AMIDES AND INTERMEDIATES THEREFOR IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) 2001-04-18 EP disclosed