SCHEMBL11816625

SCHEMBL11816625

c1ccc(-c2ccc(-c3cccc(Oc4cccc(Oc5cccc(-c6ccccc6Oc6cccc(-c7ccccc7)c6)c5)c4)c3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NCOA1 Q15788 1/20 0.49
NCOA3 Q9Y6Q9 1/20 0.49
PTGS2 P35354 1/20 0.46
FFAR4 Q5NUL3 6/20 0.45
FFAR1 O14842 2/20 0.44
GSTP1 P09211 1/20 0.44
BRD4 O60885 3/20 0.44
AR P10275 1/20 0.43
GRM5 P41594 1/20 0.41
SCN9A Q15858 1/20 0.41
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
ABL1 P00519 1/20 0.40
ABCB1 P08183 1/20 0.40
BCR P11274 1/20 0.40
MAOB P27338 1/20 0.39

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
SCHEMBL11817974 0.97 NCOA1 (0.49) NCOA1NCOA3PTGS2FFAR4FFAR1
SCHEMBL11816631 0.95 NCOA1 (0.49) NCOA1NCOA3PTGS2FFAR4FFAR1
SCHEMBL11820312 0.93 NCOA1 (0.53) NCOA1NCOA3PTGS2FFAR4FFAR1
SCHEMBL11820322 0.93 NCOA1 (0.53) NCOA1NCOA3PTGS2FFAR4FFAR1
SCHEMBL11828735 0.93 NCOA1 (0.53) NCOA1NCOA3PTGS2FFAR4FFAR1
SCHEMBL11828209 0.93 NCOA1 (0.56) NCOA1NCOA3PTGS2FFAR4GSTP1
SCHEMBL11817998 0.91 NCOA1 (0.58) NCOA1NCOA3PTGS2FFAR4FFAR1
SCHEMBL9507492 0.91 NCOA1 (0.58) NCOA1NCOA3PTGS2FFAR4FFAR1
SCHEMBL3893284 0.91 NCOA1 (0.58) NCOA1NCOA3PTGS2FFAR4FFAR1
SCHEMBL11821387 0.90 NCOA1 (0.57) NCOA1NCOA3PTGS2FFAR4FFAR1

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-3957666-A HYDRAULIC FLUIDS, HEAT TRANSFER FLUIDS MONSANTO COMPANY (US) 1976-05-18 US disclosed