SCHEMBL7067905

SCHEMBL7067905

CCc1c(Sc2ccccc2)n(CC2=CCC(CO)(CO)C2)c(=O)[nH]c1=O

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
PKM P14618 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
BRD4 O60885 2/20 0.31
BRDT Q58F21 2/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL7068727 0.87
SCHEMBL7068420 0.85 POLB (0.32) LMNAPKM
SCHEMBL7071625 0.79 ALDH1A1 (0.40) GAAALDH1A1LMNAMEN1KMT2A
SCHEMBL7071341 0.78 MEN1 (0.33) GAAALDH1A1MEN1KMT2ABRD4
SCHEMBL7071722 0.76 GAA (0.32) GAAALDH1A1MEN1KMT2ABRD4
SCHEMBL7066669 0.75 BRD4 (0.34) GAAALDH1A1LMNAPKMMEN1
SCHEMBL7071591 0.74 GAA (0.32) GAAALDH1A1MEN1KMT2ABRD4
SCHEMBL7070188 0.73
SCHEMBL7067908 0.73 MEN1 (0.32) GAAALDH1A1MEN1KMT2ABRD4
SCHEMBL7757667 0.73 LMNA (0.52) GAAALDH1A1LMNAPKMMEN1

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
EP-0827498-B1 NEW ANTIVIRAL SUBSTITUTED PYRIMIDINEDIONE HOMOCARBOCYCLIC NUCLEOSIDE DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF AND COMPOSITIONS CONTAINING THE SAME AS ACTIVE INGREDIENTS SAMJIN PHARM CO LTD (KR) 2003-06-18 EP disclosed