SCHEMBL9616884

SCHEMBL9616884

O=C(O)CCCCCC/C=C/CC(CCCCCCC(=O)O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 3/20 0.51
▸ FFAR4 Q5NUL3 3/20 0.51
▸ TBXAS1 P24557 1/20 0.47
▸ TOP1 P11387 1/20 0.47
▸ ALDH1A1 P00352 7/20 0.45
▸ F7 P08709 5/20 0.45
▸ F3 P13726 5/20 0.45
▸ CYP19A1 P11511 3/20 0.45
▸ PPARG P37231 3/20 0.45
▸ PPARD Q03181 3/20 0.45
▸ PPARA Q07869 3/20 0.45
▸ MAPT P10636 3/20 0.45
▸ LMNA P02545 3/20 0.45
▸ ALOX15 P16050 3/20 0.45
▸ HSD17B10 Q99714 3/20 0.45
▸ OXER1 Q8TDS5 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ CYP3A4 P08684 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ PTGS1 P23219 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
SCHEMBL3146207 0.83 TBXAS1 (0.58) TBXAS1ALDH1A1MAPTLMNATSHR
SCHEMBL9616885 0.82 SMN1; SMN2 (0.37) FFAR1FFAR4PPARGLMNATDP1
SCHEMBL3138839 0.80 TBXAS1 (0.55) TBXAS1ALDH1A1MAPTLMNATSHR
SCHEMBL14360161 0.80 TBXAS1 (0.55) TBXAS1ALDH1A1MAPTLMNATSHR
SCHEMBL14359790 0.80 TBXAS1 (0.54) TBXAS1ALDH1A1MAPTTSHRCYP1A2
SCHEMBL14359870 0.79 GABBR2 (0.56) TBXAS1MAPTKDM4ERECQLMEN1
SCHEMBL14360094 0.79 GABBR2 (0.56) TBXAS1MAPTKDM4ERECQLMEN1
SCHEMBL14360766 0.78 HDAC3 (0.54) TBXAS1ALDH1A1MAPTTSHRCYP1A2
Mandelic Acid SCHEMBL27842234 0.78 LMNA (0.56) FFAR1FFAR4TOP1ALDH1A1F7
SCHEMBL9693648 0.77 TBXAS1 (0.52) FFAR1FFAR4TBXAS1ALDH1A1MAPT

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
JP-4206707-A — — None — — JP disclosed
JP-H04206707-A DRIVING ELECTROLYTE OF ELECTROLYTIC CAPACITOR NICHICON CORP 1992-07-28 — — JP disclosed
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