SCHEMBL4644099

SCHEMBL4644099

COC(=O)c1c(O)cccc1OC(=O)CO

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.62
CA1 P00915 3/20 0.62
CA2 P00918 3/20 0.62
CA7 P43166 3/20 0.62
CA9 Q16790 3/20 0.62
CA14 Q9ULX7 3/20 0.62
KDM4E B2RXH2 2/20 0.43
HSD17B10 Q99714 2/20 0.43
LMNA P02545 2/20 0.42
TSHR P16473 1/20 0.42
NCEH1 Q6PIU2 1/20 0.40
PTPN1 P18031 3/20 0.40
APP P05067 1/20 0.40
THRB P10828 1/20 0.39
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL4647406 0.89 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL4642008 0.87 CA12 (0.57) CA12CA1CA2CA7CA9
SCHEMBL4642196 0.86 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL4643966 0.86 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL4644781 0.85 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL4641565 0.85 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL4647879 0.85 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL4641307 0.82 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL4642126 0.82 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL7007410 0.82 CA12 (0.69) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100519671-C Film-forming polymer and antifouling paint JOTUN AS (NO) 2009-07-29 CN disclosed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed