SCHEMBL6155225

SCHEMBL6155225

CC(C)(/C=C/C=C/C(=O)O)c1cccc(O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
CA12 O43570 4/20 0.35
CA1 P00915 4/20 0.35
CA9 Q16790 4/20 0.35
CYP26B1 Q9NR63 3/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31
MAPT P10636 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MASP2 O00187 1/20 0.31
F2 P00734 1/20 0.31
CYP26A1 O43174 1/20 0.31
PREP P48147 1/20 0.31
LMNA P02545 1/20 0.30
PPARG P37231 1/20 0.30
PPARA Q07869 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
SCHEMBL6155230 1.00 HSP90AA1 (0.41) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL6155175 0.91 HSP90AA1 (0.43) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL6155168 0.91 HSP90AA1 (0.43) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL6155576 0.77 CA12 (0.42) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL3205494 0.77 PKM (0.55) KDM4EALDH1A1
SCHEMBL3205501 0.77 PKM (0.55) KDM4EALDH1A1
SCHEMBL13282723 0.77 CACNA1B (0.45) KDM4EALDH1A1SMN1; SMN2PPARGPPARA
SCHEMBL6156121 0.76 HSD17B1 (0.38) HSP90AA1CA12CA1CA9CYP26B1
SCHEMBL6155570 0.76 CYP4F2 (0.44) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL6156129 0.76 HSD17B1 (0.38) HSP90AA1CA12CA1CA9CYP26B1

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 4 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
US-6689922-B1 BIAROMATIC COMPOUNDS WHICH ARE ANALOGUES OF VITAMIN D HAVE A MARKED ACTIVITY IN THE FIELDS OF CELL DIFFERENTIATION AND PROLIFERATION GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2004-02-10 US 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