SCHEMBL4644356

SCHEMBL4644356

CC(=O)C(=O)C(O)Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.46
MTNR1B P49286 4/20 0.46
GAA P10253 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
PKM P14618 1/20 0.42
CYP2C19 P33261 1/20 0.42
HPGD P15428 2/20 0.40
LMNA P02545 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
PPARG P37231 3/20 0.38
PPARA Q07869 3/20 0.38
SRC P12931 1/20 0.38
CHRM1 P11229 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37

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
SCHEMBL4643815 0.81 ALDH1A1 (0.47) LMNAMEN1KMT2AALDH1A1TP53
SCHEMBL4368354 0.79 CYP1A2 (0.47) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL4643658 0.78 MTNR1A (0.45) MTNR1AMTNR1BGAACYP1A2CYP2C9
Acetic Acid SCHEMBL27465373 0.75 MTNR1A (0.53) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL10971334 0.75 MTNR1A (0.41) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL216782 0.75 PARP10 (0.44) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL11513352 0.74 HPGD (0.45) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL11514680 0.73 CES2 (0.50) MTNR1AMTNR1BLMNAMEN1KMT2A
SCHEMBL4237234 0.73 TDP1 (0.53) MTNR1AMTNR1BHPGDLMNAMEN1
SCHEMBL11756005 0.72 MTNR1A (0.50) MTNR1AMTNR1BGAACYP1A2CYP2C9

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