SCHEMBL7775699

SCHEMBL7775699

CCC(O)(CC)CC/C=C(\C)c1ccccc1SCc1ccc(CO)c(CO)c1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPRG P23470 2/20 0.34
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
VDR P11473 2/20 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
SCHEMBL6155415 0.80 VDR (0.36) VDR
SCHEMBL6155400 0.80 VDR (0.36) VDR
SCHEMBL6155408 0.80 VDR (0.36) VDR
SCHEMBL7776993 0.73 VDR (0.39) KMT2AL3MBTL1VDR
SCHEMBL7778336 0.73 VDR (0.39) KMT2AL3MBTL1VDR
SCHEMBL2783953 0.70 VDR (0.58) VDR
SCHEMBL2783951 0.70 VDR (0.58) VDR
SCHEMBL2783962 0.70 VDR (0.58) VDR
SCHEMBL2781559 0.69 VDR (0.36) VDR
SCHEMBL2781568 0.69 VDR (0.36) VDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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