SCHEMBL6155676

SCHEMBL6155676

CCC(O)(CC)C(O)CCC(C)(C)c1cccc(CCc2ccc(C(O)O)cc2)c1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.31
BACE1 P56817 1/20 0.31
S1PR1 P21453 1/20 0.31
GRK5 P34947 1/20 0.31
CDK8 P49336 1/20 0.31
S1PR5 Q9H228 1/20 0.31
CETP P11597 1/20 0.30
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
VDR P11473 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
SCHEMBL6155551 0.88 S1PR1 (0.31) S1PR1GRK5CDK8S1PR5
SCHEMBL6155666 0.84 VDR (0.39) ADRB2ADRB1VDR
SCHEMBL6154726 0.82 APP (0.39)
SCHEMBL6155110 0.73 HDAC1 (0.32)
SCHEMBL6154719 0.69 VDR (0.48) VDR
SCHEMBL4169952 0.65 APP (0.40)
SCHEMBL28423129 0.65 CNR2 (0.43)
SCHEMBL6156481 0.64 MAOB (0.39)
SCHEMBL6155508 0.64 VDR (0.39) VDR
SCHEMBL18802729 0.64 TAAR1 (0.46) CETP

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 claimed
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 claimed
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