SCHEMBL2149446

SCHEMBL2149446

CCCOc1nc(Oc2cccc3c2CCC3)nc2oc(-c3cc(C)c([O])c(C)c3)nc12

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RXRA P19793 7/20 0.34
RXRB P28702 7/20 0.33
RXRG P48443 4/20 0.32
MRGPRX4 Q96LA9 1/20 0.31
S1PR1 P21453 1/20 0.31
SCN9A Q15858 1/20 0.30

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
SCHEMBL14798637 0.88 S1PR1 (0.46) RXRARXRBRXRGMRGPRX4S1PR1
SCHEMBL2148943 0.85 SMN1; SMN2 (0.34) S1PR1
SCHEMBL2146681 0.84 NPSR1 (0.34) S1PR1
SCHEMBL2146481 0.84 S1PR1 (0.33) S1PR1
SCHEMBL2146715 0.82 S1PR1 (0.40) S1PR1
SCHEMBL2146687 0.80 PPARA (0.34) S1PR1SCN9A
SCHEMBL2146623 0.80 S1PR1 (0.39) S1PR1
SCHEMBL2146320 0.80 S1PR1 (0.50) S1PR1
SCHEMBL2146207 0.80 S1PR1 (0.39) S1PR1
SCHEMBL2146707 0.79 S1PR1 (0.38) S1PR1

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-2523958-A1 CARBOXYLIC ACID DERIVATIVES HAVING A 2,5,7-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI (FR) 2012-11-21 EP disclosed
WO-2011086077-A1 CARBOXYLIC ACID DERIVATIVES HAVING A 2,5,7-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI-AVENTIS (FR) 2011-07-21 WO disclosed