SCHEMBL4641447

SCHEMBL4641447

CCOC(=O)/C=C\C(=O)OCC(=O)Oc1ccc(Br)cc1C=O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.50
MAPT P10636 7/20 0.48
ALDH1A1 P00352 4/20 0.48
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
PLA2G1B P04054 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
POLB P06746 1/20 0.41
PABPC1 P11940 1/20 0.41
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
MDM4 O15151 1/20 0.40
LMNA P02545 1/20 0.40
MDM2 Q00987 1/20 0.40
TYR P14679 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL4641451 1.00 PTGDR2 (0.50) PTGDR2MAPTALDH1A1CYP1A2CYP2C19
SCHEMBL4643572 1.00 PTGDR2 (0.50) PTGDR2MAPTALDH1A1CYP1A2CYP2C19
SCHEMBL4644074 0.90 PTGDR2 (0.50) PTGDR2MAPTALDH1A1CYP1A2CYP2C19
SCHEMBL4644085 0.90 PTGDR2 (0.50) PTGDR2MAPTALDH1A1CYP1A2CYP2C19
SCHEMBL4645491 0.90 PTGDR2 (0.50) PTGDR2MAPTALDH1A1CYP1A2CYP2C19
SCHEMBL4646939 0.83 MAPT (0.50) PTGDR2MAPTALDH1A1PLA2G1BATG4B
SCHEMBL4642192 0.83 MAPT (0.50) PTGDR2MAPTALDH1A1PLA2G1BATG4B
SCHEMBL4642184 0.83 MAPT (0.50) PTGDR2MAPTALDH1A1PLA2G1BATG4B
SCHEMBL1991262 0.78 PTGDR2 (0.68) PTGDR2MAPTALDH1A1CYP1A2CYP2C19
SCHEMBL4644055 0.78 MAPT (0.49) MAPTALDH1A1CYP1A2CYP2C19MDM4

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