SCHEMBL8215737

SCHEMBL8215737

CC(=O)c1c[nH]c(N2CCOCC2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.40
▸ PRKDC P78527 1/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ GAA P10253 2/20 0.39
▸ PIK3R1 P27986 1/20 0.39
▸ PIK3CA P42336 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ MAPT P10636 2/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ PIK3CB P42338 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ HTT P42858 2/20 0.37
▸ PDE2A O00408 1/20 0.37
▸ KMO O15229 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ POLB P06746 3/20 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
SCHEMBL14334236 0.72 KMT2A (0.43) PTGS2PRKDCMEN1KMT2AGAA
SCHEMBL18619678 0.69 LMNA (0.55) LMNA
SCHEMBL9762614 0.69 POLB (0.49) MEN1KMT2AALDH1A1MAPTTP53
SCHEMBL8216543 0.69 PIK3CA (0.41) PTGS2PRKDCMEN1KMT2AGAA
SCHEMBL12734079 0.69 IRAK4 (0.53) PTGS2GAAPIK3CAALDH1A1HSD17B10
SCHEMBL1204641 0.68 — —
SCHEMBL25877128 0.68 PIK3CA (0.48) PTGS2PIK3R1PIK3CAHSD17B10PIK3CB
SCHEMBL24766030 0.67 KMT2A (0.47) MEN1KMT2AGAAPIK3CAALDH1A1
SCHEMBL1069005 0.67 CNR2 (0.55) MEN1KMT2APIK3CAALDH1A1MAPT
SCHEMBL18412787 0.67 ALDH1A1 (0.49) MEN1KMT2AGAAPIK3CAALDH1A1

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-2000023444-A1 5,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2000-04-27 — — WO disclosed
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