SCHEMBL25220161

SCHEMBL25220161

CC(C)(C)[Si](Nc1ncnn2c(C3(O)O[C@H](COCc4ccccc4)[C@@H](OCc4ccccc4)[C@H]3OCc3ccccc3)ccc12)(c1ccccc1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 1/20 0.33
▸ PTPN1 P18031 9/20 0.33
▸ CDC25B P30305 8/20 0.33
▸ PTPN2 P17706 5/20 0.32
▸ PTPN6 P29350 3/20 0.32
▸ PTPN11 Q06124 3/20 0.32
▸ CDC25A P30304 2/20 0.32
▸ HTR1A P08908 1/20 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
SCHEMBL25263772 0.91 BCHE (0.36) BCHEPTPN1CDC25BPTPN2PTPN6
SCHEMBL25225235 0.88 TMPRSS2 (0.35) BCHE
SCHEMBL25229913 0.87 PTPN1 (0.38) BCHEPTPN1CDC25BPTPN2PTPN6
SCHEMBL13667662 0.83 PTPN1 (0.37) BCHEPTPN1CDC25BPTPN2PTPN6
SCHEMBL27086454 0.81 PDE2A (0.37) BCHEPTPN1CDC25BPTPN2PTPN6
SCHEMBL31063739 0.81 PDE2A (0.37) BCHEPTPN1CDC25BPTPN2PTPN6
SCHEMBL12243141 0.81 PDE2A (0.37) BCHEPTPN1CDC25BPTPN2PTPN6
SCHEMBL28405132 0.81 BCHE (0.38) BCHEPTPN1CDC25BPTPN2PTPN6
SCHEMBL12393373 0.81 PDE2A (0.37) BCHEPTPN1CDC25BPTPN2PTPN6
SCHEMBL17106824 0.81 PTPN1 (0.36) BCHEPTPN1CDC25BPTPN2PTPN6

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-4192839-A1 REMDESIVIR INTERMEDIATES Richter Gedeon Nyrt. (HU) 2023-06-14 — — EP disclosed
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