SCHEMBL812967

SCHEMBL812967

C=C(C)C(=O)OCc1ccc(O)c(-n2n3c4ccc(C(=O)OCC)cc4n23)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 4/20 0.43
▸ CA1 P00915 4/20 0.43
▸ CA2 P00918 4/20 0.43
▸ CA7 P43166 4/20 0.43
▸ CA9 Q16790 4/20 0.43
▸ CA14 Q9ULX7 4/20 0.43
▸ HSD17B2 P37059 1/20 0.40
▸ ESR1 P03372 1/20 0.38
▸ ESR2 Q92731 1/20 0.38
▸ MAPT P10636 3/20 0.37
▸ ALDH1A1 P00352 3/20 0.35
▸ PPARG P37231 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ NCOA2 Q15596 1/20 0.35
▸ NCOA1 Q15788 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ PABPC1 P11940 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HTT P42858 1/20 0.33

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
SCHEMBL13159274 0.87 POLB (0.37) CA12CA1CA2CA7CA9
SCHEMBL813113 0.87 POLB (0.37) CA12CA1CA2CA7CA9
SCHEMBL812949 0.82 CA1 (0.37) CA12CA1CA2CA7CA9
SCHEMBL13159276 0.82 CA1 (0.37) CA12CA1CA2CA7CA9
SCHEMBL13159291 0.81 CA12 (0.41) CA12CA1CA2CA7CA9
SCHEMBL12445255 0.81 CA12 (0.41) CA12CA1CA2CA7CA9
SCHEMBL13400579 0.79 SLC7A5 (0.32) POLBHTT
SCHEMBL13159277 0.78 CA1 (0.35) CA12CA1CA2CA7CA9
SCHEMBL812890 0.78 CA1 (0.35) CA12CA1CA2CA7CA9
SCHEMBL812893 0.78 APP (0.40) CA12CA1CA2CA7CA9

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
US-8062562-B2 Method of producing a cellulose ester film KONICA MINOLTA OPTO, INC. (JP) 2011-11-22 — — US disclosed
US-20090202823-A1 Cellulose Ester Film, Polarizing Plate and Display MURAKAMI TAKASHI 2009-08-13 — — US disclosed
US-20090202823-A1 Cellulose Ester Film, Polarizing Plate and Display MURAKAMI TAKASHI 2009-08-13 — — US disclosed
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