SCHEMBL6156550

SCHEMBL6156550

CCC(O)(CC)CCCN(C)c1cccc(OCc2ccc(CC(=O)O)c(CC(=O)O)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 2/20 0.41
MTNR1A P48039 13/20 0.40
MTNR1B P49286 13/20 0.40
PPARG P37231 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
LTB4R Q15722 1/20 0.37
LTB4R2 Q9NPC1 1/20 0.37
APP P05067 1/20 0.37
CFD P00746 1/20 0.37

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
SCHEMBL6157281 0.97 MTNR1A (0.39) BCL2MTNR1AMTNR1BPPARGPPARD
SCHEMBL6156500 0.90 MTNR1A (0.42) BCL2MTNR1AMTNR1BPPARGPPARD
SCHEMBL6156203 0.88 MTNR1A (0.42) BCL2MTNR1AMTNR1BPPARGPPARD
SCHEMBL6155372 0.87 BCL2 (0.40) BCL2CFD
SCHEMBL6155129 0.86 VDR (0.48) BCL2MTNR1AMTNR1BAPP
SCHEMBL6156102 0.83 VDR (0.48) MTNR1AMTNR1BAPP
SCHEMBL6156554 0.82 BCL2 (0.43) BCL2MTNR1AMTNR1BPPARALTB4R
SCHEMBL6155134 0.81 APP (0.43) BCL2MTNR1AMTNR1BAPP
SCHEMBL6156545 0.79 BCHE (0.47)
SCHEMBL6157286 0.79 BCL2 (0.41) BCL2MTNR1AMTNR1BPPARALTB4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1124779-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2005-02-02 EP disclosed