SCHEMBL6154987

SCHEMBL6154987

CCC(O)(CC)CCCC(C)c1cccc(COc2ccc(C(C)(C)O[SiH2]C(C)(C)C)c(C(C)(C)O[SiH2]C(C)(C)C)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGER3 P43115 1/20 0.34
FFAR1 O14842 5/20 0.33
MRGPRX4 Q96LA9 2/20 0.32
CYSLTR2 Q9NS75 1/20 0.32
CYSLTR1 Q9Y271 1/20 0.32
BCHE P06276 1/20 0.31
ADAMTS4 O75173 1/20 0.30
MMP13 P45452 1/20 0.30
MAOB P27338 1/20 0.30
GRM5 P41594 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
SCHEMBL6155769 0.92 CYSLTR2 (0.35) PTGER3FFAR1MRGPRX4CYSLTR2CYSLTR1
SCHEMBL6155413 0.85 CYSLTR2 (0.47) FFAR1MRGPRX4CYSLTR2CYSLTR1
SCHEMBL5968372 0.78 PTGER3 (0.41) PTGER3FFAR1CYSLTR2CYSLTR1BCHE
SCHEMBL2106608 0.78 MRGPRX4 (0.42) PTGER3FFAR1MRGPRX4
SCHEMBL2106606 0.78 VDR (0.43) PTGER3MRGPRX4CYSLTR2CYSLTR1BCHE
SCHEMBL6154985 0.74 PTGER3 (0.35) PTGER3FFAR1MRGPRX4CYSLTR2CYSLTR1
SCHEMBL6154980 0.74 PTGER3 (0.33) PTGER3FFAR1MRGPRX4CYSLTR2CYSLTR1
SCHEMBL6155136 0.74 FFAR1 (0.38) FFAR1CYSLTR2CYSLTR1ADAMTS4
SCHEMBL2785504 0.72 CYSLTR2 (0.40) FFAR1CYSLTR2CYSLTR1BCHE
SCHEMBL6155257 0.72 MAOB (0.52) MRGPRX4MAOB

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 3 patents. 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
EP-1124779-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2001-08-22 EP disclosed
WO-2000026167-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2000-05-11 WO disclosed