SCHEMBL6155769

SCHEMBL6155769

CC(CCCC(C)(C)O)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 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.35
CYSLTR1 Q9Y271 1/20 0.35
FFAR1 O14842 2/20 0.35
MRGPRX4 Q96LA9 2/20 0.33
PTGER3 P43115 1/20 0.33
MAOB P27338 2/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
BCHE P06276 1/20 0.33
ADAMTS4 O75173 1/20 0.32
MMP13 P45452 1/20 0.32
GRM5 P41594 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM4E B2RXH2 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL6154987 0.92 PTGER3 (0.34) CYSLTR2CYSLTR1FFAR1MRGPRX4PTGER3
SCHEMBL6155413 0.90 CYSLTR2 (0.47) CYSLTR2CYSLTR1FFAR1MRGPRX4KMT2A
SCHEMBL6155136 0.81 FFAR1 (0.38) CYSLTR2CYSLTR1FFAR1ADAMTS4
SCHEMBL6158473 0.79 CYP4F2 (0.38) FFAR1MAOBCYP4F2CYP4A11BCHE
SCHEMBL2107789 0.78 MRGPRX4 (0.44) CYSLTR2CYSLTR1FFAR1MRGPRX4CYP4F2
SCHEMBL2107787 0.78 VDR (0.40) CYSLTR2CYSLTR1FFAR1MRGPRX4PTGER3
SCHEMBL6155257 0.74 MAOB (0.52) MRGPRX4MAOBRAB9ASMN1; SMN2
SCHEMBL6155762 0.73 CYSLTR2 (0.36) CYSLTR2CYSLTR1FFAR1MRGPRX4PTGER3
SCHEMBL6155759 0.72 CYSLTR2 (0.36) CYSLTR2CYSLTR1FFAR1MRGPRX4PTGER3
SCHEMBL6155587 0.72 CYSLTR2 (0.44) CYSLTR2CYSLTR1FFAR1BCHEMEN1

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