SCHEMBL2572265

SCHEMBL2572265

c1cnc2c(Cn3nnc4ncc(-c5ccn[nH]5)nc43)cccc2c1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MET P08581 19/20 0.48
ADORA3 P0DMS8 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA2B P29275 1/20 0.44
ADORA1 P30542 1/20 0.44
CYP2C9 P11712 1/20 0.39
PDE3B Q13370 1/20 0.39
PDE3A Q14432 1/20 0.39
PDE10A Q9Y233 1/20 0.39

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
SCHEMBL2572016 0.83 MET (0.68) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL2569522 0.80 MET (0.71) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL2574066 0.79 MET (0.56) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL2572670 0.78 MET (0.56) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL2566584 0.78 MET (0.70) METPDE3BPDE3A
SCHEMBL2569722 0.78 MET (0.61) MET
SCHEMBL2572904 0.76 MET (0.49) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL2013882 0.75 MET (0.72) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL2573902 0.73 PSEN1 (0.47) MET
SCHEMBL2572431 0.73 MET (0.47) METCYP2C9PDE3BPDE3APDE10A

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-2018383-B1 TRIAZOLOPYRAZINE DERIVATIVES USEFUL AS ANTI-CANCER AGENTS PFIZER PROD INC (US) 2011-11-09 EP claimed