SCHEMBL27619948

SCHEMBL27619948

COc1cccc(C(OC)C(=O)Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.55
AOC3 Q16853 3/20 0.49
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
CHRM2 P08172 1/20 0.47
CHRM1 P11229 1/20 0.47
CHRM3 P20309 1/20 0.47
MTNR1A P48039 3/20 0.46
MTNR1B P49286 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
PARP1 P09874 1/20 0.45
POLB P06746 1/20 0.45
ALDH1A1 P00352 1/20 0.45
ENPP2 Q13822 1/20 0.43
LMNA P02545 1/20 0.42

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
SCHEMBL29544040 0.85 L3MBTL1 (0.56) L3MBTL1AOC3CES2CES1CHRM2
SCHEMBL18890289 0.85 L3MBTL1 (0.56) L3MBTL1AOC3CES2CES1CHRM2
SCHEMBL1145682 0.85 L3MBTL1 (0.56) L3MBTL1AOC3CES2CES1CHRM2
SCHEMBL29544093 0.85 L3MBTL1 (0.56) L3MBTL1AOC3CES2CES1CHRM2
SCHEMBL21326187 0.85 L3MBTL1 (0.56) L3MBTL1AOC3CES2CES1CHRM2
SCHEMBL29543522 0.83 L3MBTL1 (0.63) L3MBTL1AOC3CES2CES1CHRM2
Hydrochloric Acid SCHEMBL7051120 0.83 L3MBTL1 (0.55) L3MBTL1AOC3CES2CES1CHRM2
SCHEMBL819872 0.81 PTGS1 (0.53) L3MBTL1AOC3CES2CES1MTNR1A
SCHEMBL27617808 0.81 L3MBTL1 (0.53) L3MBTL1AOC3CES2CES1CHRM2
SCHEMBL5888900 0.81 PTGS1 (0.53) L3MBTL1AOC3CES2CES1MTNR1A

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 2 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
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN disclosed