SCHEMBL2223229

SCHEMBL2223229

O=C(O)O[C@H]1CCCN1C(=O)CCc1ccc(-c2nc3cnc(Oc4ccccc4F)nc3o2)cc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRCP P42785 9/20 0.41
ACACB O00763 1/20 0.37
FFAR4 Q5NUL3 2/20 0.36
GRIN2B Q13224 1/20 0.35
BTK Q06187 2/20 0.34
FFAR1 O14842 1/20 0.34
S1PR1 P21453 1/20 0.34
PKM P14618 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
SCHEMBL14777065 0.90 GYS1 (0.41) PRCPACACBFFAR4
SCHEMBL2223226 0.90 GYS1 (0.41) PRCPACACBFFAR4
SCHEMBL2223318 0.89 CPT1A (0.41) PRCPFFAR1S1PR1
SCHEMBL15309961 0.89 S1PR1 (0.39) PRCPFFAR4GRIN2BFFAR1S1PR1
SCHEMBL14777677 0.88 PRCP (0.38) PRCPACACBFFAR4GRIN2BBTK
SCHEMBL15310017 0.86 CPT1A (0.38) FFAR1S1PR1
SCHEMBL2222697 0.85 HRH3 (0.37) GRIN2BBTKFFAR1S1PR1
SCHEMBL2223289 0.84 S1PR1 (0.42) PRCPS1PR1
SCHEMBL2222097 0.84 THRB (0.38) ACACBGRIN2BFFAR1S1PR1
SCHEMBL2224649 0.83 S1PR1 (0.51) PRCPGRIN2BFFAR1S1PR1

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 4 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-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