SCHEMBL16587174

SCHEMBL16587174

CCn1cc(-c2cnc3nnn(Cc4n[nH]c5ccccc45)c3n2)cn1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MET P08581 19/20 0.56
CYP2C9 P11712 1/20 0.46
PDE3B Q13370 1/20 0.46
PDE3A Q14432 1/20 0.46
PDE10A Q9Y233 1/20 0.46
PIM1 P11309 1/20 0.45

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
SCHEMBL12689727 0.88 MET (0.60) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL16587110 0.79 MET (0.61) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL12487158 0.77 MET (0.75) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL12689708 0.77 MET (0.60) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL12689713 0.77 MET (0.76) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL16587146 0.76 MET (0.53) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL16587143 0.76 MET (0.59) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL12689730 0.76 MET (0.74) MET
SCHEMBL12489807 0.76 MET (0.80) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL12489857 0.75 MET (0.80) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8987269-B2 Certain triazolopyridines and triazolopyrazines, compositions thereof and methods of use therefor HUTCHISON MEDIPHARMA LIMITED (CN) 2015-03-24 US disclosed
US-8987269-B2 Certain triazolopyridines and triazolopyrazines, compositions thereof and methods of use therefor HUTCHISON MEDIPHARMA LIMITED (CN) 2015-03-24 US disclosed