SCHEMBL6557220

SCHEMBL6557220

Cc1ccc(C(CO)C(O)CO)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
ALDH1A1 P00352 5/20 0.38
MAPT P10636 4/20 0.38
CHRNA7 P36544 1/20 0.37
ACHE P22303 3/20 0.36
TDP1 Q9NUW8 2/20 0.35
LMNA P02545 2/20 0.35
ESR1 P03372 1/20 0.35
CYP1A2 P05177 1/20 0.35
PGR P06401 1/20 0.35
CHRM2 P08172 1/20 0.35
CYP3A4 P08684 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
AR P10275 1/20 0.35
CYP2D6 P10635 1/20 0.35
CHRM1 P11229 1/20 0.35
CYP2C9 P11712 1/20 0.35
ALOX15 P16050 1/20 0.35

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
SCHEMBL23086300 0.83 CHRNA7 (0.37) ALDH1A1MAPTCHRNA7ACHETDP1
SCHEMBL30297441 0.80 PPARG (0.52) PPARGPPARDPPARAALDH1A1MAPT
SCHEMBL8737008 0.80 ACHE (0.41) ALDH1A1MAPTCHRNA7ACHETDP1
SCHEMBL14256595 0.80 ACHE (0.41) ALDH1A1MAPTCHRNA7ACHETDP1
SCHEMBL27510025 0.77 PPARG (0.44) PPARGPPARDPPARAALDH1A1MAPT
SCHEMBL10359670 0.76 STAT3 (0.33) ALDH1A1MAPTCHRNA7ACHETDP1
SCHEMBL11641922 0.75 PPARG (0.40) PPARGPPARDPPARAALDH1A1MAPT
SCHEMBL6493189 0.75 TSHR (0.46) ALDH1A1MAPTCHRNA7ACHETDP1
SCHEMBL28986558 0.75 TSHR (0.46) ALDH1A1MAPTCHRNA7ACHETDP1
SCHEMBL6134241 0.75 TSHR (0.46) ALDH1A1MAPTCHRNA7ACHETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1391278-A1 VEHICLE USED TO APPLY CHEMICAL COMPOUNDS TO WOOD Rodriguez Ramos, Rafael (ES) 2004-02-25 EP disclosed
US-6673836-B2 TO WOOD, TOLUENE, XYLENE, BENZOPHENONE, BUTYL GLYCOL, CETYL ACETATE AND METHANOL RAMOS RAFAEL RODRIGUEZ (ES) 2004-01-06 US disclosed
US-20030162781-A1 Vehicle for applying chemical compounds on wood RODRIGUEZ RAMOS RAFAEL (ES) 2003-08-28 US disclosed