SCHEMBL6036330

SCHEMBL6036330

Nc1nc(N)c2ncn(-n3cnc4cncnc43)c2n1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 3/20 0.44
CCNB1 P14635 2/20 0.44
CCNE1 P24864 2/20 0.44
CDK2 P24941 2/20 0.44
ADORA2A P29274 7/20 0.35
ADORA1 P30542 5/20 0.35
AHCY P23526 1/20 0.34
PI4KA P42356 5/20 0.34
PI4K2B Q8TCG2 5/20 0.34
PI4K2A Q9BTU6 5/20 0.34
PI4KB Q9UBF8 5/20 0.34
FDPS P14324 1/20 0.33
ADORA2B P29275 2/20 0.33
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
EGFR P00533 2/20 0.31
SRC P12931 1/20 0.31
KDR P35968 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
SCHEMBL851861 0.86 FDPS (0.32) CDK1CCNB1CCNE1CDK2FDPS
SCHEMBL852593 0.86 HSP90AB1 (0.41) HSP90AA1HSP90AB1
SCHEMBL120720 0.83 ADORA2A (0.49) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL28480707 0.83 CDK1 (0.47) CDK1CCNB1CCNE1CDK2ADORA2A
SCHEMBL27983442 0.82 CDK1 (0.59) CDK1CCNB1CCNE1CDK2ADORA2A
SCHEMBL9014630 0.81 FDPS (0.36) FDPSHSP90AA1HSP90AB1EGFR
SCHEMBL2120550 0.79 FDPS (0.45) FDPSEGFR
SCHEMBL28340215 0.77 FDPS (0.44) FDPSEGFR
SCHEMBL523465 0.75 XDH (0.47)
SCHEMBL5607948 0.75 XDH (0.31) FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1034180-B1 LINKER NUCLEOSIDE, AND PRODUCTION AND USE OF THE SAME NANOGEN RECOGNOMICS GMBH (DE) 2006-03-29 EP claimed
EP-1017703-B1 PENTOPYRANOSYL NUCLEOSIDE, AND PRODUCTION AND USE OF THE SAME NANOGEN RECOGNOMICS GMBH (DE) 2004-04-28 EP claimed
EP-1017704-B1 USE OF A PENTOPYRANOSYL NUCLEOSIDE CONTAINING CONJUGATE FOR PRODUCING AN ARRAY NANOGEN RECOGNOMICS GMBH (DE) 2004-02-25 EP claimed
US-6545134-B1 Reacting a nucleoside with aldehyde, ketone NANOGEN RECOGNOMICS, GMBH. (DE) 2003-04-08 US claimed
EP-1019423-B1 METHOD FOR PRODUCING A PENTOPYRANOSYL NUCLEOSIDE NANOGEN RECOGNOMICS GMBH (DE) 2003-02-26 EP claimed
CN-110025628-A That treats neuromuscular disorder there is the RNA for improving characteristic to adjust oligonucleotides 比奥马林技术公司 2019-07-19 CN disclosed
CN-103946364-B system and method for multiplex analysis 赛拉诺斯知识产权有限责任公司 2018-04-24 CN disclosed