SCHEMBL16631478

SCHEMBL16631478

CCc1cc2nc(F)c(C(F)(F)F)[nH]c-2nc1=O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.34
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
PTGES O14684 2/20 0.31
AR P10275 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
SCHEMBL18081973 0.82 PDE3B (0.32) PDE3BPDE3AAR
SCHEMBL18080551 0.79 PDE2A (0.31) PDE3BPDE3APTGES
SCHEMBL16631930 0.75 HCAR2 (0.31) HCAR2
SCHEMBL16631474 0.74 DGAT1 (0.41)
SCHEMBL16631745 0.74 HCAR2 (0.34) HCAR2PDE3BPDE3AAR
SCHEMBL16631475 0.71
SCHEMBL16631430 0.70 KDM4E (0.36) HCAR2AR
SCHEMBL16631477 0.69 PDE3B (0.33) PDE3BPDE3AAR
SCHEMBL18080224 0.68 KDM4E (0.39)
SCHEMBL18080554 0.68

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
WO-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 WO disclosed