SCHEMBL29315325

SCHEMBL29315325

CCOC1CCCCC1OC(=O)OC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPK1 P28482 1/20 0.35
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 2/20 0.33
THRB P10828 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP2D6 P10635 1/20 0.32
SERPINE1 P05121 2/20 0.32
NAAA Q02083 2/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31

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
SCHEMBL19329246 0.87 SOAT1 (0.37) EPHX1MAPK1ALDH1A1SMN1; SMN2THRB
SCHEMBL1080565 0.86 SERPINE1 (0.38) EPHX1KDM4EALDH1A1SMN1; SMN2NPSR1
SCHEMBL1078000 0.85 ALDH1A1 (0.43) EPHX1KDM4EALDH1A1NPSR1THRB
SCHEMBL9216168 0.82 CHRM2 (0.36) EPHX1KDM4EALDH1A1NPSR1THRB
SCHEMBL29315321 0.81 CHRM2 (0.40) EPHX1MAPK1ALDH1A1SMN1; SMN2CYP2D6
SCHEMBL15503284 0.80 KDM4E (0.41) EPHX1KDM4EALDH1A1NPSR1SERPINE1
SCHEMBL31426332 0.79 CHRM2 (0.46) EPHX1MAPK1ALDH1A1SMN1; SMN2CYP2D6
SCHEMBL29315110 0.79 AKT1 (0.35) EPHX1KDM4ENAAACHRM2CHRM4
SCHEMBL29315338 0.79 CHRM2 (0.43) EPHX1KDM4EALDH1A1NPSR1CYP2D6
SCHEMBL1080656 0.79 SERPINE1 (0.34) EPHX1KDM4EALDH1A1NPSR1SERPINE1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239934-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2024-07-18 US disclosed
US-20240239934-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2024-07-18 US disclosed