SCHEMBL6880160

SCHEMBL6880160

COC(=O)c1ccc(COc2cccc(C(C)C/C=C/C(C)(C)O)c2)cc1C(=O)OC

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.42
MRGPRX4 Q96LA9 2/20 0.39
ADAMTS4 O75173 2/20 0.37
PTGER3 P43115 1/20 0.37
PTPN1 P18031 1/20 0.36
ALOX5AP P20292 1/20 0.36

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
SCHEMBL6880164 1.00 FFAR1 (0.42) FFAR1MRGPRX4ADAMTS4PTGER3PTPN1
SCHEMBL6881435 0.91 FFAR1 (0.39) FFAR1MRGPRX4ADAMTS4PTGER3PTPN1
SCHEMBL6881433 0.91 FFAR1 (0.39) FFAR1MRGPRX4ADAMTS4PTGER3PTPN1
SCHEMBL6155553 0.88 FFAR1 (0.43) FFAR1MRGPRX4ADAMTS4
SCHEMBL6155559 0.88 FFAR1 (0.43) FFAR1MRGPRX4ADAMTS4
SCHEMBL6155865 0.81 FFAR1 (0.40) FFAR1ADAMTS4
SCHEMBL6155872 0.80 VDR (0.49) FFAR1
SCHEMBL6155852 0.80 VDR (0.49) FFAR1
SCHEMBL6881337 0.80 CYSLTR2 (0.42) FFAR1MRGPRX4ALOX5AP
SCHEMBL6156514 0.80 FFAR1 (0.41) FFAR1MRGPRX4PTGER3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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