SCHEMBL27601475

SCHEMBL27601475

COc1ccc(C(Cl)C(=O)C(C)=O)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.49
PPARG P37231 1/20 0.49
PPARD Q03181 1/20 0.49
PPARA Q07869 1/20 0.49
GAA P10253 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CYP2C19 P33261 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA12 O43570 1/20 0.43
CA4 P22748 1/20 0.43

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
SCHEMBL10622251 0.83 ACHE (0.59) ACHEPPARGPPARDPPARATDP1
SCHEMBL27617794 0.83 PPARG (0.51) ACHEPPARGPPARDPPARAGAA
SCHEMBL7294943 0.83 ACHE (0.55) ACHEPPARGPPARDPPARACYP2C19
SCHEMBL187559 0.81 CYP2C19 (0.52) ACHEPPARGPPARDPPARACYP2C19
SCHEMBL27619953 0.81 ACHE (0.54) ACHEPPARGPPARDPPARAGAA
SCHEMBL11826687 0.79 TSHR (0.56) ACHEPPARGPPARDPPARAGAA
SCHEMBL4643994 0.77 TSHR (0.44) TDP1CYP1A2CYP2C9TSHRKMT2A
SCHEMBL11752093 0.76 ACHE (0.49) ACHEPPARGPPARDPPARAGAA
SCHEMBL28545301 0.76 ACHE (0.46) ACHEPPARGPPARDPPARAGAA
SCHEMBL11755052 0.75 LMNA (0.52) ACHEPPARGPPARDPPARAGAA

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