SCHEMBL8460286

SCHEMBL8460286

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

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ELANE P08246 11/20 0.49
L3MBTL1 Q9Y468 3/20 0.45
ATM Q13315 2/20 0.45
MAPT P10636 4/20 0.43
ALDH1A1 P00352 2/20 0.43
HSP90AA1 P07900 1/20 0.43
GAA P10253 1/20 0.43
CYP3A4 P08684 1/20 0.42
TDP1 Q9NUW8 3/20 0.41

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
SCHEMBL16993559 0.81 ELANE (0.51) ELANEL3MBTL1ATMMAPTTDP1
SCHEMBL21841151 0.80 ELANE (0.44) ELANEL3MBTL1ATMMAPTTDP1
SCHEMBL2342588 0.78 ELANE (0.72) ELANEL3MBTL1ATMTDP1
SCHEMBL28932489 0.77 ELANE (0.57) ELANEL3MBTL1ATMMAPTALDH1A1
SCHEMBL28008255 0.76 ELANE (0.47) ELANEL3MBTL1ATMMAPTTDP1
SCHEMBL7940288 0.76 ELANE (0.55) ELANEL3MBTL1ATMMAPTALDH1A1
Ammonia Solution, Strong SCHEMBL11257764 0.76 ELANE (0.70) ELANEL3MBTL1ATMTDP1
SCHEMBL833149 0.76 ELANE (0.55) ELANEL3MBTL1ATMMAPTALDH1A1
SCHEMBL27589344 0.76 ELANE (0.55) ELANEL3MBTL1ATMMAPTALDH1A1
SCHEMBL28197586 0.76 ELANE (0.70) ELANEL3MBTL1ATMTDP1

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-5989527-A Compositions and methods for improving the performance of chemical exfoliating agents, sunless tanning agents, skin lightening agents and insect repellents INOLEX INVESTMENT CORPORATION (US) 1999-11-23 US disclosed