SCHEMBL27769476

SCHEMBL27769476

CC(=O)OC(C)=O.Cc1csc(N)n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.67
NOS1 P29475 1/20 0.67
ALDH1A1 P00352 7/20 0.46
MAPT P10636 6/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 1/20 0.46
PIK3CG P48736 1/20 0.41
HSD17B10 Q99714 3/20 0.41
GABRA5 P31644 1/20 0.41
GABRB2 P47870 1/20 0.41
LMNA P02545 2/20 0.39
BAZ2A Q9UIF9 1/20 0.38
GFER P55789 1/20 0.38
KDM4E B2RXH2 3/20 0.38
TSHR P16473 2/20 0.37
HTT P42858 2/20 0.37
PKM P14618 1/20 0.37
TDP1 Q9NUW8 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
SCHEMBL48592 0.82
Hydrochloric Acid SCHEMBL1966505 0.80
Hydrochloric Acid SCHEMBL4139462 0.80
Water SCHEMBL9185862 0.80
SCHEMBL7026518 0.75 SMN1; SMN2 (0.75) SMN1; SMN2NOS1ALDH1A1MAPTMEN1
SCHEMBL27742441 0.73 GABRA5 (0.60) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL1000856 0.72 ALDH1A1 (0.44) SMN1; SMN2NOS1ALDH1A1MAPTMEN1
Hydrochloric Acid SCHEMBL11102564 0.70 ALDH1A1 (0.46) SMN1; SMN2NOS1ALDH1A1MAPTMEN1
SCHEMBL965863 0.68
SCHEMBL354383 0.68 GABRA5 (0.54) SMN1; SMN2NOS1ALDH1A1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101627019-B Bicyclic pyrimidinones and uses thereof AVEXA LTD 2013-07-10 CN disclosed
CN-101880280-A Bicyclic pyrimidinones and uses thereof SHANGHAI INST ORGANIC CHEM 2010-11-10 CN disclosed
CN-101627019-A Bicyclic pyrimidinones and uses thereof AVEXA LTD 2010-01-13 CN disclosed