SCHEMBL6155834

SCHEMBL6155834

CC(=CC=CC(=O)O)c1cccc(CCc2ccc(C(C)(C)O[SiH2]C(C)(C)C)c(C(C)(C)O[SiH2]C(C)(C)C)c2)c1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARA P10276 2/20 0.33
RARB P10826 2/20 0.33
RARG P13631 2/20 0.33
RXRA P19793 2/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
CYP26A1 O43174 1/20 0.32
CYP26B1 Q9NR63 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
AKR1C4 P17516 1/20 0.32
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
SLC7A5 Q01650 1/20 0.31
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 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
SCHEMBL3280514 0.89 VDR (0.41) CYP26A1CYP26B1MRGPRX4CYP4F2CYP4A11
SCHEMBL6155650 0.87 MRGPRX4 (0.42) MRGPRX4
SCHEMBL6158586 0.86 VDR (0.35)
SCHEMBL6155584 0.84 VDR (0.36)
SCHEMBL6156234 0.83 MAOB (0.39) MRGPRX4SLC7A5CYP4F2CYP4A11
SCHEMBL6155477 0.82 RARA (0.33) RARARARBRARGRXRARXRB
SCHEMBL3280119 0.80 PDPK1 (0.36) MRGPRX4SLC7A5CYP4F2CYP4A11
SCHEMBL4405455 0.79 CYP4F2 (0.36) MRGPRX4SLC7A5CYP4F2CYP4A11
SCHEMBL4407806 0.77 VDR (0.40) CYP4F2CYP4A11
SCHEMBL6563074 0.76 DAO (0.33)

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