SCHEMBL6065985

SCHEMBL6065985

CC(Oc1ccccc1)=C(C)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.47
MAPT P10636 4/20 0.46
ALDH1A1 P00352 2/20 0.46
GAA P10253 2/20 0.44
HSP90AA1 P07900 1/20 0.44
TDP1 Q9NUW8 3/20 0.44
ATM Q13315 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CYP1A2 P05177 1/20 0.41
KDM4E B2RXH2 1/20 0.40
NSD2 O96028 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39

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
SCHEMBL2956113 0.83 ELANE (0.47) ELANEMAPTALDH1A1GAAHSP90AA1
SCHEMBL11547873 0.81 ELANE (0.46) ELANEMAPTALDH1A1GAAHSP90AA1
SCHEMBL6204762 0.79 ELANE (0.53) ELANEMAPTALDH1A1GAAHSP90AA1
SCHEMBL9562937 0.78 ELANE (0.52) ELANEMAPTALDH1A1GAAHSP90AA1
SCHEMBL6204752 0.78 ELANE (0.52) ELANEMAPTALDH1A1GAAHSP90AA1
Acetic Acid Phenyl Ester SCHEMBL6422166 0.77 ELANE (0.72) ELANEMAPTALDH1A1GAAHSP90AA1
Acetic Acid Phenyl Ester SCHEMBL35500 0.77 ELANE (0.72) ELANEMAPTALDH1A1GAAHSP90AA1
SCHEMBL372385 0.76 ELANE (0.45) ELANEMAPTALDH1A1GAAHSP90AA1
SCHEMBL15254 0.76 ELANE (0.45) ELANEMAPTALDH1A1GAAHSP90AA1
Benzene SCHEMBL27375213 0.76 ELANE (0.45) ELANEMAPTALDH1A1GAAHSP90AA1

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-20060257632-A1 Ink composition FUJI PHOTO FILM CO., LTD. 2006-11-16 US disclosed