SCHEMBL17934445

SCHEMBL17934445

CCc1ccc(/C=C2\SC(=O)N(Cc3ccc(OC)c(OC)c3)C2=O)cc1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 9/20 0.62
▸ MYC P01106 1/20 0.59
▸ MAX P61244 1/20 0.59
▸ PTPN1 P18031 5/20 0.58
▸ ACP1 P24666 4/20 0.58
▸ PTPN2 P17706 4/20 0.57
▸ HPGD P15428 1/20 0.56
▸ NPSR1 Q6W5P4 1/20 0.56

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
SCHEMBL17927382 0.89 MYC (0.57) ENPP2MYCMAXNPSR1
SCHEMBL17927383 0.89 MYC (0.57) ENPP2MYCMAXNPSR1
SCHEMBL17927334 0.87 MYC (0.57) ENPP2MYCMAXNPSR1
SCHEMBL17927331 0.87 MYC (0.57) ENPP2MYCMAXNPSR1
SCHEMBL17927318 0.82 MYC (0.60) MYCMAXPTPN1ACP1PTPN2
SCHEMBL17927319 0.82 MYC (0.60) MYCMAXPTPN1ACP1PTPN2
SCHEMBL17927311 0.81 MYC (0.54) ENPP2MYCMAXPTPN1ACP1
SCHEMBL17927309 0.81 MYC (0.54) ENPP2MYCMAXPTPN1ACP1
SCHEMBL15828847 0.81 NPSR1 (0.67) ENPP2NPSR1
SCHEMBL5463956 0.79 ENPP2 (0.57) ENPP2PTPN1ACP1PTPN2HPGD

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
WO-2016115360-A1 C-MYC LIGANDS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME COFERON, INC. (US) 2016-07-21 — — WO disclosed
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