SCHEMBL4647869

SCHEMBL4647869

[CH2]CC(=O)OC(=O)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 7/20 0.53
NPSR1 Q6W5P4 2/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
CYP2C19 P33261 2/20 0.36
HIF1A Q16665 1/20 0.36
CYP1A2 P05177 2/20 0.35
HTT P42858 1/20 0.35
CYP2C9 P11712 1/20 0.34
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
DRD2 P14416 1/20 0.33
OPRM1 P35372 1/20 0.33
DRD3 P35462 1/20 0.33
AKR1B1 P15121 1/20 0.33
CES1 P23141 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL4644357 0.86 KCNN4 (0.50) KCNN4NPSR1ALDH1A1TSHRCYP2C19
SCHEMBL4646095 0.83 KCNN4 (0.47) KCNN4NPSR1ALDH1A1TSHRCYP2C19
SCHEMBL4643825 0.82 CYP1A2 (0.50) KCNN4ALDH1A1TSHRCYP2C19HIF1A
SCHEMBL7587514 0.82 KCNN4 (0.68) KCNN4NPSR1ALDH1A1CYP2C19HIF1A
SCHEMBL28021017 0.81 KCNN4 (0.53) KCNN4NPSR1ALDH1A1TSHRCYP2C19
SCHEMBL4642195 0.79 KCNN4 (0.59) KCNN4NPSR1ALDH1A1TSHRCYP2C19
SCHEMBL23798386 0.75 KCNN4 (0.59) KCNN4NPSR1ALDH1A1TSHRCYP2C19
SCHEMBL4642200 0.75 KCNN4 (0.64) KCNN4NPSR1ALDH1A1TSHRCYP2C19
SCHEMBL240550 0.74 SLC13A5 (0.46) KCNN4ALDH1A1TSHRCYP2C19HIF1A
SCHEMBL28848759 0.73 KCNN4 (0.62) KCNN4NPSR1ALDH1A1TSHRCYP2C19

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