SCHEMBL10143359

SCHEMBL10143359

COc1ncccc1-c1c(C(=O)O)n(Cc2cc(F)ccc2F)c2c1=CC(Cl)CN=2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.36
PPARG P37231 2/20 0.33
RORC P51449 1/20 0.32
HIF1A Q16665 1/20 0.32
DHODH Q02127 1/20 0.32
FPR1 P21462 1/20 0.32
FPR2 P25090 1/20 0.32
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
GPR6 P46095 2/20 0.31
HTT P42858 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31
TRPM8 Q7Z2W7 1/20 0.31
P2RX7 Q99572 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ROCK2 O75116 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
SCHEMBL10143853 0.82 CYP2C8 (0.43) RORC
SCHEMBL862857 0.77 FFAR4 (0.34) FFAR4PPARGHIF1ADHODHHTR2A
SCHEMBL12655673 0.77 FFAR4 (0.34) FFAR4PPARGHIF1ADHODHHTR2A
SCHEMBL14802300 0.77 PPARG (0.41) FFAR4PPARGRORCHIF1ADHODH
SCHEMBL832411 0.76 EDNRB (0.49) PPARGTP53
SCHEMBL14025926 0.76 PPARG (0.37) FFAR4PPARGRORCTP53
SCHEMBL13395458 0.76 FFAR4 (0.35) FFAR4PPARGRORCDHODHTP53
SCHEMBL12624289 0.75 HTR2A (0.36) FFAR4PPARGHTR2AHTR2CHTR2B
SCHEMBL832329 0.75 HTR2A (0.36) FFAR4PPARGHTR2AHTR2CHTR2B
SCHEMBL830167 0.75 EDNRB (0.42) FFAR4TP53

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
EP-2195317-B1 2,3-SUBSTITUTED AZAINDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS SCHERING CORP (US) 2012-01-18 EP disclosed
WO-2009032125-A1 2,3-SUBSTITUTED AZAINDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS SCHERING CORPORATION (US) 2009-03-12 WO disclosed