SCHEMBL11829776

SCHEMBL11829776

c1ccc(Oc2ccccc2Oc2cccc(Oc3ccc(-c4ccccc4)cc3-c3ccccc3)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NCOA1 Q15788 1/20 0.47
▸ NCOA3 Q9Y6Q9 1/20 0.47
▸ PTGS2 P35354 1/20 0.45
▸ GSTP1 P09211 1/20 0.43
▸ FFAR4 Q5NUL3 4/20 0.41
▸ HTR2A P28223 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ FFAR1 O14842 1/20 0.40
▸ BRD4 O60885 3/20 0.40
▸ TTR P02766 1/20 0.39
▸ SLC6A9 P48067 1/20 0.39
▸ AR P10275 1/20 0.39
▸ BTK Q06187 1/20 0.39
▸ MAOB P27338 1/20 0.38
▸ SCN9A Q15858 1/20 0.37
▸ ACACB O00763 1/20 0.37
▸ ACACA Q13085 1/20 0.37

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
SCHEMBL11818603 0.97 NCOA1 (0.49) NCOA1NCOA3PTGS2GSTP1FFAR4
SCHEMBL11843004 0.95 GSTP1 (0.50) NCOA1NCOA3PTGS2GSTP1FFAR4
SCHEMBL11815013 0.95 GSTP1 (0.49) NCOA1NCOA3PTGS2GSTP1FFAR4
SCHEMBL11818921 0.95 GSTP1 (0.49) NCOA1NCOA3PTGS2GSTP1FFAR4
SCHEMBL11815327 0.93 GSTP1 (0.51) NCOA1NCOA3PTGS2GSTP1FFAR4
SCHEMBL11818436 0.93 GSTP1 (0.51) NCOA1NCOA3PTGS2GSTP1FFAR4
SCHEMBL11817781 0.92 GSTP1 (0.53) NCOA1NCOA3PTGS2GSTP1FFAR4
SCHEMBL11820028 0.92 GSTP1 (0.49) NCOA1NCOA3PTGS2GSTP1FFAR4
SCHEMBL9217384 0.91 GSTP1 (0.50) NCOA1NCOA3PTGS2GSTP1FFAR4
SCHEMBL11820969 0.90 GSTP1 (0.47) NCOA1NCOA3PTGS2GSTP1FFAR4

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
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