SCHEMBL9770359

SCHEMBL9770359

COc1ccc(OCCC(Oc2ccc(OC)cc2)C(=O)O)cc1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.67
PPARA Q07869 10/20 0.67
MAPT P10636 1/20 0.49
MAPK1 P28482 1/20 0.47
MTNR1A P48039 1/20 0.47
MTNR1B P49286 1/20 0.47
LDHA P00338 1/20 0.47
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
TAS1R2 Q8TE23 1/20 0.46
ALDH1A1 P00352 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
PTGES O14684 1/20 0.45
ALOX5 P09917 1/20 0.45
PPARD Q03181 2/20 0.45

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
SCHEMBL9858456 0.84 PPARG (0.50) PPARGPPARAMAPTALDH1A1PTGES
SCHEMBL13923928 0.83 PPARG (0.65) PPARGPPARALDHATAS1R3TAS1R1
SCHEMBL1564807 0.81 PPARA (0.59) PPARGPPARALDHATAS1R3TAS1R1
SCHEMBL23605982 0.80 MAPK1 (0.54) MAPTMAPK1MTNR1AMTNR1BLDHA
SCHEMBL1745447 0.80 PPARG (0.66) PPARGPPARAMTNR1AMTNR1BLDHA
SCHEMBL21991991 0.80 PPARG (0.66) PPARGPPARAMTNR1AMTNR1BLDHA
SCHEMBL16242008 0.80 PPARG (0.66) PPARGPPARAMTNR1AMTNR1BLDHA
SCHEMBL9614202 0.79 PPARG (0.57) PPARGPPARAPTGESALOX5
SCHEMBL11854295 0.78 CTRC (0.58) PPARGPPARALDHATAS1R3TAS1R1
SCHEMBL8981961 0.77 MAPT (0.49) PPARGPPARAMAPTMAPK1MTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4981836-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1991-01-01 US disclosed
US-4835133-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1989-05-30 US disclosed