SCHEMBL2225559

SCHEMBL2225559

Cc1cc(-c2nc3cnc(Oc4cccc(F)c4F)nc3o2)cc(C)c1[O]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.49
SGMS2 Q8NHU3 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
TTK P33981 2/20 0.33
IMPDH2 P12268 1/20 0.33
SCN9A Q15858 1/20 0.33
APP P05067 6/20 0.33
MAOB P27338 1/20 0.33
CEPT1 Q9Y6K0 3/20 0.32
TP53 P04637 1/20 0.32
THRB P10828 1/20 0.32
TRPA1 O75762 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 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
SCHEMBL2222186 0.92 S1PR1 (0.48) S1PR1SGMS2LMNAMAPTRXFP1
SCHEMBL2222541 0.91 S1PR1 (0.51) S1PR1SGMS2MAPTSCN9AAPP
SCHEMBL2223599 0.88 S1PR1 (0.47) S1PR1LMNAMAPTRXFP1SCN9A
SCHEMBL2222292 0.88 S1PR1 (0.44) S1PR1TRPA1
SCHEMBL2224919 0.87 S1PR1 (0.49) S1PR1SGMS2MAPTRXFP1CEPT1
SCHEMBL2223699 0.86 S1PR1 (0.45) S1PR1RXFP1APPMAOBCEPT1
SCHEMBL2222071 0.85 S1PR1 (0.44) S1PR1LMNAMAPTRXFP1SCN9A
SCHEMBL2223727 0.85 S1PR1 (0.47) S1PR1LMNAMAPTRXFP1APP
SCHEMBL14797108 0.85 S1PR1 (0.70) S1PR1LMNAMAPTRXFP1TTK
SCHEMBL2222985 0.84 S1PR1 (0.52) S1PR1MAPTSCN9AMAOBCEPT1

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-2523962-A1 CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI (FR) 2012-11-21 EP disclosed
WO-2011086079-A1 CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI-AVENTIS (FR) 2011-07-21 WO disclosed