SCHEMBL24026322

SCHEMBL24026322

C=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(C)cc2)c(OC)cc1O

nearest known ligand 0.85

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 14/20 0.85
DPP4 P27487 6/20 0.85
ABCG2 Q9UNQ0 2/20 0.85
IDH1 O75874 1/20 0.85
ABCB1 P08183 1/20 0.85
UGT1A1 P22309 1/20 0.85
ABCC1 P33527 1/20 0.85
PRMT6 Q96LA8 1/20 0.85
SNCA P37840 1/20 0.53
CXCL12 P48061 1/20 0.53

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
Licoagrochacone A SCHEMBL114042 0.92 PTPN1 (1.00) PTPN1DPP4ABCG2IDH1ABCB1
Licoagrochacone A SCHEMBL30383634 0.92 PTPN1 (1.00) PTPN1DPP4ABCG2IDH1ABCB1
Licoagrochacone A SCHEMBL4906294 0.92 PTPN1 (1.00) PTPN1DPP4ABCG2IDH1ABCB1
Licoagrochacone A SCHEMBL29929441 0.92 PTPN1 (1.00) PTPN1DPP4ABCG2IDH1ABCB1
SCHEMBL7185962 0.86 PTPN1 (0.81) PTPN1DPP4ABCG2IDH1ABCB1
SCHEMBL7185966 0.86 PTPN1 (0.81) PTPN1DPP4ABCG2IDH1ABCB1
SCHEMBL7191527 0.84 PTPN1 (1.00) PTPN1DPP4ABCG2IDH1ABCB1
SCHEMBL7191524 0.84 PTPN1 (1.00) PTPN1DPP4ABCG2IDH1ABCB1
Licoagrochacone A SCHEMBL25196053 0.82 PTPN1 (0.80) PTPN1DPP4ABCG2IDH1ABCB1
SCHEMBL7179782 0.82 PTPN1 (1.00) PTPN1DPP4ABCG2IDH1ABCB1

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
EP-2471501-B2 Oil/water active ingredient emulsion containing UV filter BEIERSDORF AG (DE) 2021-11-17 EP disclosed