SCHEMBL13952048

SCHEMBL13952048

O=C1C2=C(C(=O)N1OS(=O)(=O)c1c(F)c(F)c(F)c(F)c1F)C1CCC2O1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ XBP1 P17861 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL5551755 0.75 KDM4E (0.41) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL13821988 0.73 PPM1B (0.34) KDM4E
SCHEMBL4829749 0.70 CA1 (0.33) MEN1KMT2A
SCHEMBL503521 0.70 PARL (0.52) MEN1KMT2AKDM4EMAPTHPGD
SCHEMBL13620303 0.69 KDM4E (0.43) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL4834476 0.69 CA12 (0.34) —
SCHEMBL2898286 0.68 KMT2A (0.66) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL17195062 0.68 KMT2A (0.35) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL20176709 0.67 POLB (0.37) KMT2AHPGD
SCHEMBL16765756 0.67 ATM (0.37) CYP3A4MAPTHPGD

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
US-20090045552-A1 Positive resist composition for recording medium master, and method of producing recording medium master and method of producing stamper using the same IMAI GENJI 2009-02-19 — — US disclosed
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