SCHEMBL15966903

SCHEMBL15966903

Cc1cc(-c2nc3cnc(Oc4ccccc4F)nc3o2)ccc1S(C)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.42
PTPN2 P17706 6/20 0.36
PTPN1 P18031 6/20 0.36
PTPN5 P54829 6/20 0.36
HSPD1 P10809 2/20 0.36
HSPE1 P61604 2/20 0.36
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
APP P05067 2/20 0.34
CEPT1 Q9Y6K0 3/20 0.33
BRD4 O60885 1/20 0.33
NR1H3 Q13133 1/20 0.33
TP53 P04637 1/20 0.33
THRB P10828 1/20 0.33
SGK1 O00141 1/20 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
SCHEMBL2228824 0.84 S1PR1 (0.42) S1PR1MAPTLMNARXFP1APP
SCHEMBL2225375 0.84 S1PR1 (0.44) S1PR1MAPTLMNARXFP1APP
SCHEMBL2222186 0.84 S1PR1 (0.48) S1PR1MAPTLMNARXFP1APP
SCHEMBL2222684 0.82 S1PR1 (0.48) S1PR1MAPTLMNARXFP1APP
SCHEMBL2225593 0.81 S1PR1 (0.52) S1PR1MAPTLMNARXFP1APP
SCHEMBL15966917 0.81 MAPK14 (0.43) S1PR1BRD4
SCHEMBL14797019 0.80 S1PR1 (0.56) S1PR1MAPTLMNARXFP1CEPT1
SCHEMBL2224059 0.78 S1PR1 (0.51) S1PR1MAPTLMNARXFP1APP
SCHEMBL2225216 0.77 S1PR1 (0.69) S1PR1PTPN1MAPTLMNARXFP1
SCHEMBL2224473 0.77 NPC1 (0.40) S1PR1PTPN2PTPN1PTPN5MAPT

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
US-9040544-B2 2,5-substituted oxazolopyrimidine derivatives SANOFI (FR) 2015-05-26 US claimed
EP-2523963-B1 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE DERIVATIVES AS EDG-1 AGONISTS SANOFI SA (FR) 2014-08-27 EP disclosed