SCHEMBL13839012

SCHEMBL13839012

C=C(C)C(=O)OCCOC(=O)CCc1ccc(O)c(-n2n3c4ccc(OC(C)=O)cc4n23)c1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ APEX1 P27695 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ ALOX5 P09917 1/20 0.32
▸ YWHAG P61981 1/20 0.32
▸ ABCB11 O95342 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ SLC5A1 P13866 1/20 0.30
▸ SLC5A2 P31639 1/20 0.30

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
SCHEMBL13159307 0.91 APP (0.38) APPTDP1POLBAPEX1HTT
SCHEMBL813463 0.91 APP (0.38) APPTDP1POLBAPEX1HTT
SCHEMBL812980 0.86 ALOX5 (0.34) TDP1POLBAPEX1HTTALOX5
SCHEMBL13159301 0.86 ALOX5 (0.34) TDP1POLBAPEX1HTTALOX5
SCHEMBL812893 0.84 APP (0.40) APPTDP1POLBAPEX1HTT
SCHEMBL13400577 0.84 NPC1 (0.37) APPTDP1POLBAPEX1HTT
SCHEMBL813116 0.82 APP (0.38) APPTDP1POLBAPEX1HTT
SCHEMBL13159287 0.82 APP (0.38) APPTDP1POLBAPEX1HTT
SCHEMBL813002 0.81 APP (0.38) APPTDP1POLBAPEX1HTT
SCHEMBL13159264 0.81 APP (0.38) APPALDH1A1

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-20090135345-A1 Polarizing Plate Protective Film, Film Producing Method, Polarizing Plate, and Liquid Crystal Display KONICA MINOLTA OPTO, INC. (JP) 2009-05-28 — — US disclosed
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