SCHEMBL3435155

SCHEMBL3435155

CC(NC(=O)c1cnc(-n2cccn2)nc1O)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 6/20 0.63
ALDH1A1 P00352 4/20 0.48
MAPK1 P28482 1/20 0.48
KDM4E B2RXH2 3/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
LMNA P02545 1/20 0.47
PDE2A O00408 2/20 0.47
DCTPP1 Q9H773 1/20 0.45
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
THRB P10828 1/20 0.44
MAPK8 P45983 1/20 0.44
ROCK1 Q13464 1/20 0.43

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
SCHEMBL4535795 1.00 EGLN1 (0.63) EGLN1ALDH1A1MAPK1KDM4EHPGD
SCHEMBL3405250 1.00 EGLN1 (0.63) EGLN1ALDH1A1MAPK1KDM4EHPGD
SCHEMBL12851536 0.93 EGLN1 (0.54) EGLN1ALDH1A1MAPK1KDM4EHPGD
SCHEMBL4537749 0.92 EGLN1 (0.55) EGLN1ALDH1A1MAPK1KDM4EHPGD
SCHEMBL3409508 0.92 EGLN1 (0.64) EGLN1PDE2A
SCHEMBL3407323 0.92 EGLN1 (0.54) EGLN1ALDH1A1MAPK1KDM4EHPGD
SCHEMBL3409543 0.92 EGLN1 (0.54) EGLN1ALDH1A1MAPK1KDM4EHPGD
SCHEMBL3409110 0.92 EGLN1 (0.64) EGLN1PDE2A
SCHEMBL3408585 0.92 EGLN1 (0.64) EGLN1PDE2A
SCHEMBL3409470 0.91 EGLN1 (0.54) EGLN1ALDH1A1MAPK1PDE2AMAPK8

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-2257539-A1 SUBSTITUTED 4-HYDROXYPYRIMIDINE-5-CARBOXAMIDES Merck Sharp & Dohme Corp. (US) 2010-12-08 EP disclosed
WO-2009117269-A1 SUBSTITUTED 4-HYDROXYPYRIMIDINE-5-CARBOXAMIDES MERCK & CO., INC. (US) 2009-09-24 WO disclosed