SCHEMBL21952152

SCHEMBL21952152

CCOC(C#Cc1cnc(Cl)nc1NCCN(C(=O)O)C(C)(C)C)OCC

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
STK17B O94768 1/20 0.36
STK17A Q9UEE5 1/20 0.36

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
SCHEMBL21952195 0.83
SCHEMBL2725643 0.82 STK17B (0.38) STK17BSTK17A
SCHEMBL29437385 0.80 STK17B (0.55) STK17BSTK17A
SCHEMBL2722836 0.80 STK17B (0.55) STK17BSTK17A
SCHEMBL4187304 0.78 STK17A (0.35) STK17BSTK17A
SCHEMBL17836544 0.76 PTK2 (0.31)
SCHEMBL23868053 0.76 STK17B (0.52) STK17BSTK17A
SCHEMBL2724784 0.76 STK17B (0.34) STK17BSTK17A
SCHEMBL21967063 0.75 SYK (0.30)
SCHEMBL21967074 0.74 STK17B (0.33) STK17BSTK17A

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-3653209-A1 TRANSIENT PROTECTION OF NORMAL CELLS DURING CHEMOTHERAPY G1 Therapeutics, Inc. (US) 2020-05-20 EP disclosed