SCHEMBL2223289

SCHEMBL2223289

Cc1cc(-c2nc3cnc(Oc4ccccc4F)nc3o2)ccc1OCC(=O)N1CCC[C@@H]1OC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.42
S1PR5 Q9H228 1/20 0.39
MAPT P10636 3/20 0.36
RXFP1 Q9HBX9 2/20 0.36
LMNA P02545 1/20 0.36
CEPT1 Q9Y6K0 4/20 0.36
TP53 P04637 2/20 0.36
THRB P10828 1/20 0.36
CPT1A P50416 3/20 0.35
PRCP P42785 1/20 0.35
HPGD P15428 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CETP P11597 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
CPT2 P23786 1/20 0.34

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
SCHEMBL15310017 0.94 CPT1A (0.38) S1PR1MAPTRXFP1LMNACPT1A
SCHEMBL2224649 0.92 S1PR1 (0.51) S1PR1S1PR5MAPTRXFP1LMNA
SCHEMBL2223287 0.91 KMT2A (0.44) S1PR1S1PR5MAPTRXFP1LMNA
SCHEMBL14777954 0.91 KMT2A (0.44) S1PR1S1PR5MAPTRXFP1LMNA
SCHEMBL15310209 0.90 S1PR1 (0.39) S1PR1CPT1ACETPCPT2
SCHEMBL2223318 0.89 CPT1A (0.41) S1PR1CPT1APRCPCPT2
SCHEMBL15309961 0.89 S1PR1 (0.39) S1PR1S1PR5MAPTRXFP1LMNA
SCHEMBL15309983 0.87 S1PR1 (0.51) S1PR1MAPTRXFP1LMNACEPT1
SCHEMBL15310101 0.87 S1PR1 (0.37) S1PR1S1PR5MAPTRXFP1LMNA
SCHEMBL15310073 0.84 CPT1A (0.41) S1PR1CPT1APRCPCPT2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2523960-B1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI SA (FR) 2013-10-16 EP claimed
EP-2523960-A1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI (FR) 2012-11-21 EP claimed
WO-2011086080-A1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI-AVENTIS (FR) 2011-07-21 WO claimed
EP-2523960-B1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI SA (FR) 2013-10-16 EP disclosed
EP-2523960-A1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI (FR) 2012-11-21 EP disclosed
WO-2011086080-A1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI-AVENTIS (FR) 2011-07-21 WO disclosed