Sugi Predict

Sugi Predict / Compounds / SCHEMBL7610474

SCHEMBL7610474

SCHEMBL7610474

Cc1cc(CC(C)(C)C(O)C(c2ccc(-c3cccc(OCc4ccc(CO)c(CO)c4)c3)c(C)c2)C(C)CO)ccc1-c1cccc(OCc2ccc(CO)c(CO)c2)c1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 3/20 0.38
▸ FFAR1 O14842 9/20 0.36
▸ PTGS2 P35354 1/20 0.33
▸ FFAR4 Q5NUL3 1/20 0.32

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
SCHEMBL6565081 0.82 VDR (0.43) VDRFFAR1FFAR4
SCHEMBL6566235 0.82 VDR (0.43) VDRFFAR1PTGS2FFAR4
SCHEMBL7614670 0.82 VDR (0.46) VDRFFAR1FFAR4
SCHEMBL7608820 0.79 VDR (0.43) VDRFFAR1FFAR4
SCHEMBL7611585 0.79 VDR (0.42) VDRFFAR1PTGS2FFAR4
SCHEMBL7612585 0.78 VDR (0.44) VDRFFAR1FFAR4
SCHEMBL6565020 0.76 VDR (0.48) VDRFFAR1FFAR4
SCHEMBL7610502 0.75 VDR (0.42) VDRFFAR1PTGS2FFAR4
SCHEMBL7610505 0.74 VDR (0.43) VDRFFAR1FFAR4
SCHEMBL6566495 0.74 MAOB (0.46) VDRFFAR1FFAR4

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-1235777-A2 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2002-09-04 — — EP claimed
WO-2001038303-A2 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2001-05-31 — — WO claimed
EP-1235777-A2 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2002-09-04 — — EP disclosed
WO-2001038303-A2 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2001-05-31 — — WO disclosed