SCHEMBL7752187

SCHEMBL7752187

CC(CO)C(O)n1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 2/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
CYP3A4 P08684 1/20 0.54
NFKB1 P19838 1/20 0.54
VCP P55072 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HIF1A Q16665 1/20 0.54
HPRT1 P00492 6/20 0.53
TK1 P04183 2/20 0.51
PNP P00491 2/20 0.50
HBB P68871 2/20 0.50
USP2 O75604 1/20 0.50
TSHR P16473 1/20 0.50
EDNRA P25101 1/20 0.50
HTR2A P28223 1/20 0.50
RECQL P46063 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL26378516 0.89 BLM (0.48) BLMMEN1KMT2AALDH1A1LMNA
SCHEMBL6455102 0.84 HPRT1 (0.56) BLMMEN1KMT2AALDH1A1LMNA
SCHEMBL10018373 0.84 MEN1 (0.55) BLMMEN1KMT2AALDH1A1LMNA
SCHEMBL8493226 0.83 HPRT1 (0.54) BLMMEN1KMT2AALDH1A1LMNA
SCHEMBL23169714 0.82 MEN1 (0.52) BLMMEN1KMT2AALDH1A1LMNA
SCHEMBL5580122 0.82 BLM (0.51) BLMMEN1KMT2AALDH1A1LMNA
SCHEMBL9364021 0.82 MEN1 (0.54) BLMMEN1KMT2AALDH1A1LMNA
SCHEMBL2385929 0.81 HPRT1 (0.55) BLMMEN1KMT2AALDH1A1LMNA
SCHEMBL19049896 0.81 MEN1 (0.50) BLMMEN1KMT2AALDH1A1LMNA
SCHEMBL19662085 0.81 HPRT1 (0.56) BLMMEN1KMT2AALDH1A1LMNA

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
EP-1019404-A4 PURINE ACYCLONUCLEOSIDES AS ANTIVIRAL AGENTS COMMW SCIENT IND RES ORG (AU) 2001-07-04 EP disclosed
EP-1019404-A1 PURINE ACYCLONUCLEOSIDES AS ANTIVIRAL AGENTS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2000-07-19 EP disclosed
WO-1999012927-A1 PURINE ACYCLONUCLEOSIDES AS ANTIVIRAL AGENTS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1999-03-18 WO disclosed