SCHEMBL4641508

SCHEMBL4641508

COC(=O)C=CC(=O)OCCCC(O)C(=O)Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ZDHHC2 Q9UIJ5 1/20 0.41
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
HCAR2 Q8TDS4 3/20 0.40
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 2/20 0.39
AKR1B10 O60218 2/20 0.38
AKR1B1 P15121 2/20 0.38
LMNA P02545 3/20 0.38
THRB P10828 2/20 0.38
MAPT P10636 2/20 0.38
ALOX5 P09917 1/20 0.37
ATM Q13315 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MDM4 O15151 1/20 0.36
MDM2 Q00987 1/20 0.36

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
SCHEMBL4642181 0.92 ADRB2 (0.42) ZDHHC2ADRB2ADRB1ADRB3TDP1
SCHEMBL4643328 0.90 TDP1 (0.49) ZDHHC2TDP1HCAR2ALDH1A1LMNA
SCHEMBL4647853 0.82 MAPT (0.48) ZDHHC2TDP1HCAR2ALDH1A1LMNA
SCHEMBL4643910 0.79 CYP3A4 (0.43) TDP1ALDH1A1KDM4EAKR1B10AKR1B1
SCHEMBL18355254 0.78 ZDHHC2 (0.51) ZDHHC2L3MBTL1
SCHEMBL27676784 0.76 TDP1 (0.45) ZDHHC2ADRB2ADRB1ADRB3TDP1
SCHEMBL7941063 0.76 TDP1 (0.45) ZDHHC2ADRB2ADRB1ADRB3TDP1
SCHEMBL18355459 0.76 ALDH1A1 (0.46) ZDHHC2TDP1HCAR2ALDH1A1KDM4E
SCHEMBL8609738 0.75 HCAR2 (0.54) ZDHHC2HCAR2ALDH1A1KDM4EMAPT
SCHEMBL10706264 0.75 HCAR2 (0.54) ZDHHC2HCAR2ALDH1A1KDM4EMAPT

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