SCHEMBL7937489

SCHEMBL7937489

CCNc1nc(NC)nc2c(NCC)ncnc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.37
KDM4E B2RXH2 1/20 0.36
EGFR P00533 3/20 0.35
FFAR2 O15552 1/20 0.35
PGK1 P00558 2/20 0.34
SLC29A1 Q99808 1/20 0.34
YTHDC1 Q96MU7 2/20 0.33
YTHDF2 Q9Y5A9 2/20 0.33
KHK P50053 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
CCNB2 O95067 1/20 0.31
CDK1 P06493 1/20 0.31
CCNB1 P14635 1/20 0.31
CCNB3 Q8WWL7 1/20 0.31
FLT3 P36888 1/20 0.31
PRKCD Q05655 1/20 0.31
CAMK2B Q13554 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
SCHEMBL7937484 0.90 SLC29A1 (0.39) MAP4K4KDM4EFFAR2SLC29A1KHK
SCHEMBL16094713 0.87 SLC29A1 (0.42) EGFRSLC29A1KHKBCHEACHE
Hydrochloric Acid SCHEMBL16094548 0.86 SLC29A1 (0.41) EGFRSLC29A1KHKBCHEACHE
SCHEMBL7942601 0.80 YTHDC1 (0.46) MAP4K4KDM4EEGFRYTHDC1YTHDF2
SCHEMBL7930938 0.78 LMNA (0.41) MAP4K4KDM4EFFAR2PGK1ADORA3
SCHEMBL7937472 0.77 SLC29A1 (0.51) SLC29A1KHKBCHEACHECCNB2
SCHEMBL16094412 0.74 SLC29A1 (0.42) SLC29A1YTHDC1YTHDF2KHKBCHE
SCHEMBL18806440 0.73 LMNA (0.50) SLC29A1BCHEACHEFLT3PRKCD
SCHEMBL20164633 0.72 SLC29A1 (0.58) KDM4ESLC29A1CCNB2CDK1CCNB1
Hydrochloric Acid SCHEMBL20164454 0.71 SLC29A1 (0.56) SLC29A1CCNB2CDK1CCNB1CCNB3

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
US-6232312-B1 ADMINISTERING A COMBINATION OF INDENE AND PYRIMIDO(5,4-D)PYRIMIDINE DERIVATIVES TO TREAT PREPANCREATIC CANCER CELL PATHWAYS, INC. 2001-05-15 US disclosed