SCHEMBL4642186

SCHEMBL4642186

CCC[CH]C(=O)Oc1ccc(OC)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.45
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
LMNA P02545 2/20 0.44
GAA P10253 1/20 0.44
FAAH O00519 1/20 0.43
GSK3B P49841 2/20 0.43
MAOB P27338 1/20 0.43
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
F3 P13726 1/20 0.42
HDAC3 O15379 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
SCHEMBL4645333 0.85 THRB (0.45) THRBKMT2AMEN1LMNACA1
SCHEMBL4644289 0.85 KMT2A (0.47) KMT2AMEN1CES2CES1LMNA
SCHEMBL4647636 0.84 NQO1 (0.50) THRBKMT2AMEN1LMNAMAOB
SCHEMBL4646065 0.84 MGLL (0.49) THRBKMT2AMEN1LMNAMAOB
SCHEMBL6247098 0.83 ZDHHC2 (0.48) THRBKMT2AMEN1FAAH
SCHEMBL4641285 0.83 MGLL (0.54) KMT2AMEN1CA1CA2CYP2C9
SCHEMBL4641754 0.82 CA12 (0.49) KMT2AMEN1LMNAGAACA1
SCHEMBL4646694 0.82 KMT2A (0.53) THRBKMT2AMEN1LMNASMN1; SMN2
SCHEMBL4645454 0.80 TDP1 (0.40) THRBKMT2AMEN1LMNAMAOB
SCHEMBL4644775 0.79 KMT2A (0.52) KMT2ALMNAGAACYP2C19SMN1; SMN2

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
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP 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