SCHEMBL4643815

SCHEMBL4643815

CC(=O)C(=O)C(O)Oc1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
PPARG P37231 2/20 0.41
PPARA Q07869 2/20 0.41
MAOB P27338 3/20 0.39
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
LMNA P02545 2/20 0.38
POLB P06746 3/20 0.36
ALOX15 P16050 1/20 0.36
GFER P55789 1/20 0.36
ADAM17 P78536 1/20 0.36
MAOA P21397 1/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
TP53 P04637 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
SCHEMBL4644356 0.81 MTNR1A (0.46) ALDH1A1PPARGPPARALMNAKMT2A
SCHEMBL4641913 0.80 ALDH1A1 (0.46) ALDH1A1PPARGPPARAMAOBMAPT
SCHEMBL6617425 0.73 ALDH1A1 (0.64) ALDH1A1PPARGPPARAMAPTSMN1; SMN2
SCHEMBL11515931 0.71 PPARG (0.50) ALDH1A1PPARGPPARAMAPTSMN1; SMN2
SCHEMBL23912995 0.71 ALDH1A1 (0.52) ALDH1A1PPARGPPARAMAOBMAPT
SCHEMBL4641885 0.71 HDAC3 (0.42) ALDH1A1MAPTSMN1; SMN2LMNAPOLB
SCHEMBL4401878 0.70 ALDH1A1 (0.51) ALDH1A1PPARGPPARAMAPTSMN1; SMN2
SCHEMBL15156205 0.70 ALDH1A1 (0.47) ALDH1A1PPARGPPARAMAOBMAPT
SCHEMBL9819072 0.69 CYP1A2 (0.65) ALDH1A1PPARGPPARAMAPTSMN1; SMN2
SCHEMBL9818914 0.69 CYP1A2 (0.65) ALDH1A1PPARGPPARAMAPTSMN1; SMN2

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-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed