SCHEMBL3715709

SCHEMBL3715709

CCOC=Cc1cnc(Cl)nc1NCCCN

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
STK17A Q9UEE5 19/20 0.39
STK17B O94768 12/20 0.39
ALDH1A1 P00352 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL4182957 0.89 STK17A (0.38) STK17ASTK17BALDH1A1L3MBTL1
SCHEMBL3715707 0.82 STK17B (0.38) STK17ASTK17BALDH1A1L3MBTL1
SCHEMBL3715708 0.82 STK17B (0.38) STK17ASTK17BALDH1A1L3MBTL1
SCHEMBL1284631 0.78 TBK1 (0.44) STK17ASTK17BALDH1A1
SCHEMBL12984819 0.76 ALDH1A1 (0.35) STK17ASTK17BALDH1A1L3MBTL1
SCHEMBL12984823 0.76 ALDH1A1 (0.35) STK17ASTK17BALDH1A1L3MBTL1
SCHEMBL13195356 0.76 KMT2A (0.35) ALDH1A1L3MBTL1
SCHEMBL1233615 0.76 CSNK1A1 (0.37) ALDH1A1L3MBTL1
SCHEMBL1233630 0.76 CSNK1A1 (0.37) ALDH1A1L3MBTL1
SCHEMBL4182956 0.75 CRHR1 (0.37) ALDH1A1L3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2403853-B1 PYRROLOPYRIMIDINES USED AS KINASE INHIBITORS MEDICAL RES COUNCIL TECHNOLOGY (GB) 2013-08-14 EP disclosed
WO-2010100431-A1 PYRROLOPYRIMIDINES USED AS KINASE INHIBITORS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2010-09-10 WO disclosed