SCHEMBL19506111

SCHEMBL19506111

COC(=O)[C@@H]1CC(OS(=O)(=O)C(F)(F)F)=CN1C(=O)c1c(O)cccc1OCOCC[Si](C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 2/20 0.31

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
SCHEMBL19506080 0.89 KMT2A (0.33) —
SCHEMBL19475631 0.89 DRD2 (0.32) —
SCHEMBL19475632 0.89 DRD2 (0.32) —
SCHEMBL19505789 0.85 GRM5 (0.32) —
SCHEMBL19505986 0.78 PTPN1 (0.31) PTPN1
SCHEMBL19475772 0.78 L3MBTL1 (0.36) —
SCHEMBL21917065 0.78 LOXL2 (0.34) —
SCHEMBL21917067 0.78 LOXL2 (0.34) —
SCHEMBL19506112 0.76 MMP2 (0.35) PTPN1
SCHEMBL19505804 0.74 KMT2A (0.44) —

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-2017184558-A1 NOVEL PROMYSALIN ANALOGUES AND METHODS OF USE THEREOF TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2017-10-26 — — WO disclosed
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