SCHEMBL19987207

SCHEMBL19987207

CC(N)CC1(C)C(F)[C@H](n2cnc3c(NCc4ccccc4)nc(Cl)nc32)O[C@@H]1COP(=O)(N[C@@H](C)C(=O)OC(C)C)Oc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NT5E P21589 19/20 0.52

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
SCHEMBL19987158 0.94 NT5E (0.53) NT5E
SCHEMBL19987170 0.94 NT5E (0.53) NT5E
SCHEMBL19987168 0.93 NT5E (0.52) NT5E
SCHEMBL21511156 0.92 NT5E (0.51) NT5E
SCHEMBL21511237 0.91 NT5E (0.51) NT5E
SCHEMBL19987166 0.89 NT5E (0.48) NT5E
SCHEMBL19987160 0.86 DNPH1 (0.46) NT5E
SCHEMBL19987313 0.85 NT5E (0.44) NT5E
SCHEMBL19987203 0.85 NT5E (0.44) NT5E
SCHEMBL19987157 0.85 NT5E (0.44) NT5E

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-2018049535-A1 NUCLEOSIDE ANALOGUES AND METHODS OF USE THEREOF LCB PHARMA INC. (CA) 2018-03-22 WO disclosed