SCHEMBL28749029

SCHEMBL28749029

[CH2]C(C)C1(Cn2cnc3cnc(N)nc32)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
ADRA1A P35348 1/20 0.44
HSD17B10 Q99714 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
HDAC6 Q9UBN7 2/20 0.40
IRAK4 Q9NWZ3 5/20 0.35
CCNE1 P24864 3/20 0.31
CDK2 P24941 3/20 0.31
CDK1 P06493 2/20 0.31
CCNB1 P14635 2/20 0.31
RPS6KA3 P51812 1/20 0.31
SLC29A1 Q99808 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
SCHEMBL2905776 0.80 KDM4E (0.43) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL27576990 0.80 CDK2 (0.41) HSP90AA1HSP90AB1CCNE1CDK2CDK1
SCHEMBL3291053 0.79 KDM4E (0.45) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL14138147 0.77 HDAC6 (0.46) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL2914353 0.73 KDM4E (0.46) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL14642669 0.73 CDK1 (0.56) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL2942557 0.72 KDM4E (0.42) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL6950568 0.72 ALDH1A1 (0.62) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL2914357 0.72 KDM4E (0.46) KDM4EALDH1A1HPGDADRA1AHSD17B10
SCHEMBL2942561 0.71 HSP90AA1 (0.45) KDM4EALDH1A1HPGDADRA1AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100347185-C Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same LG LIFE SCIENCE CO LTD (KR) 2007-11-07 CN claimed
CN-1487949-A Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same ��ʽ����LG������ѧ 2004-04-07 CN claimed
CN-1921867-B Nucleoside phosphonate derivatives for the treatment of HIV infection LG LIFE SCIENCES LTD 2010-05-05 CN disclosed
CN-100347185-C Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same LG LIFE SCIENCE CO LTD (KR) 2007-11-07 CN disclosed
CN-1487949-A Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same ��ʽ����LG������ѧ 2004-04-07 CN disclosed