SCHEMBL2934283

SCHEMBL2934283

CC(C)OC(=O)OC[C](COC(=O)OC(C)C)OC1(Cn2cnc3cnc(N)nc32)CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
ADRA1A P35348 1/20 0.46
HSD17B10 Q99714 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
HDAC6 Q9UBN7 2/20 0.38
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 1/20 0.35
FAP Q12884 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.31
PIK3R1 P27986 1/20 0.30
PIK3CA P42336 1/20 0.30

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
SCHEMBL2943563 0.90 KDM4E (0.47) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL2940680 0.89 KDM4E (0.45) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL2942651 0.87 KDM4E (0.43) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL2943206 0.86 KDM4E (0.43) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL2942826 0.86 FAP (0.35) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL4274985 0.82 KDM4E (0.45) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL2904680 0.81 KDM4E (0.42) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL2943566 0.77 KDM4E (0.49) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL2943210 0.77 KDM4E (0.47) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL2941709 0.76 HK1 (0.35) ALDH1A1HSP90AA1HSP90AB1FAP

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-1358198-B1 NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME LG LIFE SCIENCES LTD (KR) 2010-08-25 EP claimed