SCHEMBL2222186

SCHEMBL2222186

Cc1cc(-c2nc3cnc(Oc4ccccc4F)nc3o2)cc(C)c1[O]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.48
MAPT P10636 4/20 0.36
LMNA P02545 2/20 0.36
RXFP1 Q9HBX9 1/20 0.36
SGMS2 Q8NHU3 2/20 0.35
CEPT1 Q9Y6K0 4/20 0.34
TP53 P04637 1/20 0.34
THRB P10828 1/20 0.34
APP P05067 4/20 0.34
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PIN1 Q13526 1/20 0.33
ALOX5AP P20292 2/20 0.33

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
SCHEMBL2223599 0.92 S1PR1 (0.47) S1PR1MAPTLMNARXFP1CEPT1
SCHEMBL2225559 0.92 S1PR1 (0.49) S1PR1MAPTLMNARXFP1SGMS2
SCHEMBL2222292 0.92 S1PR1 (0.44) S1PR1
SCHEMBL2224919 0.91 S1PR1 (0.49) S1PR1MAPTRXFP1SGMS2CEPT1
SCHEMBL2222071 0.89 S1PR1 (0.44) S1PR1MAPTLMNARXFP1TP53
SCHEMBL2223727 0.89 S1PR1 (0.47) S1PR1MAPTLMNARXFP1TP53
SCHEMBL2222684 0.89 S1PR1 (0.48) S1PR1MAPTLMNARXFP1SGMS2
SCHEMBL2222588 0.89 S1PR1 (0.52) S1PR1MAPTLMNARXFP1CEPT1
SCHEMBL2223699 0.88 S1PR1 (0.45) S1PR1RXFP1CEPT1TP53THRB
SCHEMBL2225593 0.88 S1PR1 (0.52) S1PR1MAPTLMNARXFP1SGMS2

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