SCHEMBL11818603

SCHEMBL11818603

c1ccc(Oc2ccccc2Oc2cccc(Oc3ccc(-c4ccc(Oc5cccc(Oc6ccccc6Oc6ccccc6)c5)c(-c5ccccc5)c4)cc3)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NCOA1 Q15788 1/20 0.49
▸ NCOA3 Q9Y6Q9 1/20 0.49
▸ GSTP1 P09211 1/20 0.49
▸ FFAR4 Q5NUL3 5/20 0.45
▸ FFAR1 O14842 2/20 0.45
▸ PTGS2 P35354 1/20 0.43
▸ BTK Q06187 1/20 0.42
▸ HTR2A P28223 1/20 0.42
▸ SLC6A4 P31645 1/20 0.42
▸ ACACB O00763 1/20 0.41
▸ ACACA Q13085 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ MITF O75030 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ GFER P55789 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ NLRP1 Q9C000 1/20 0.41

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
SCHEMBL11818436 0.97 GSTP1 (0.51) NCOA1NCOA3GSTP1FFAR4FFAR1
SCHEMBL11815327 0.97 GSTP1 (0.51) NCOA1NCOA3GSTP1FFAR4FFAR1
SCHEMBL11829776 0.97 NCOA1 (0.47) NCOA1NCOA3GSTP1FFAR4FFAR1
SCHEMBL11843004 0.95 GSTP1 (0.50) NCOA1NCOA3GSTP1FFAR4FFAR1
SCHEMBL11818921 0.95 GSTP1 (0.49) NCOA1NCOA3GSTP1FFAR4FFAR1
SCHEMBL11815013 0.95 GSTP1 (0.49) NCOA1NCOA3GSTP1FFAR4FFAR1
SCHEMBL11821442 0.92 GSTP1 (0.54) NCOA1NCOA3GSTP1FFAR4FFAR1
SCHEMBL11817781 0.92 GSTP1 (0.53) NCOA1NCOA3GSTP1FFAR4FFAR1
SCHEMBL11820028 0.92 GSTP1 (0.49) NCOA1NCOA3GSTP1FFAR4FFAR1
SCHEMBL9211542 0.92 GSTP1 (0.56) NCOA1NCOA3GSTP1FFAR4FFAR1

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
Send feedback