SCHEMBL3889923

SCHEMBL3889923

COC(=O)c1ccnc(Cl)c1C(=O)OC(C)(C)C

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.65
PSMD14 O00487 1/20 0.42
POLB P06746 2/20 0.40
KDM4E B2RXH2 6/20 0.39
ALDH1A1 P00352 3/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
TDP1 Q9NUW8 2/20 0.37
LMNA P02545 1/20 0.36
SLC40A1 Q9NP59 1/20 0.36
ABL1 P00519 1/20 0.36
MAP2K1 Q02750 1/20 0.35
ATM Q13315 1/20 0.35
KDM6B O15054 1/20 0.34
KDM5C P41229 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
KDM2A Q9Y2K7 1/20 0.34
KDM3A Q9Y4C1 1/20 0.34

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
Ammonia Solution, Strong SCHEMBL28841959 0.91 ATR (0.53) ATRPOLBALDH1A1TDP1LMNA
SCHEMBL31254527 0.88 ATR (0.55) ATRPSMD14POLBKDM4EALDH1A1
SCHEMBL15231394 0.88 ATR (0.55) ATRPSMD14POLBKDM4EALDH1A1
SCHEMBL23971145 0.82 ATR (0.50) ATRPOLBKDM4EALDH1A1GLA
SCHEMBL8530313 0.81 ATR (0.49) ATRPOLBKDM4EALDH1A1GLA
SCHEMBL8527621 0.80 ATR (0.48) ATRPOLBKDM4EALDH1A1GLA
SCHEMBL30496272 0.80 ATR (0.48) ATRPOLBALDH1A1TDP1LMNA
SCHEMBL25239851 0.80 ATR (0.48) ATRPOLBALDH1A1TDP1LMNA
SCHEMBL3668394 0.79 ATR (0.58) ATRPSMD14POLBKDM4EALDH1A1
SCHEMBL17501015 0.79 ATR (1.00) ATRPSMD14POLBKDM4EALDH1A1

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-2097416-A1 AZAQUINOLONE BASED COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF Amgen, Inc (US) 2009-09-09 EP disclosed
WO-2008076425-A1 AZAQUINOLONE BASED COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF AMGEN INC. (US) 2008-06-26 WO disclosed