SCHEMBL28126185

SCHEMBL28126185

C(OCC1CO1)C1CO1.Oc1cccc(-c2ccccc2)c1CC1CO1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 3/20 0.39
HPGD P15428 1/20 0.39
BCL2L1 Q07817 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MGLL Q99685 6/20 0.37
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HIF1A Q16665 1/20 0.36
GLA P06280 1/20 0.34

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
SCHEMBL28047810 0.87 MGLL (0.43) TDP1ALDH1A1HPGDBCL2L1HSD17B10
2-Phenylphenol SCHEMBL811951 0.86 ALDH1A1 (0.55) TDP1ALDH1A1HPGDBCL2L1HSD17B10
SCHEMBL28047820 0.85 MGLL (0.44) TDP1MGLL
SCHEMBL3854585 0.85 TDP1 (0.42) TDP1ALDH1A1HPGDBCL2L1HSD17B10
2-Phenylphenol SCHEMBL27865739 0.82 ALDH1A1 (0.50) TDP1ALDH1A1HPGDBCL2L1HSD17B10
2-Phenylphenol SCHEMBL22325689 0.80 ALDH1A1 (0.47) TDP1ALDH1A1HPGDBCL2L1HSD17B10
SCHEMBL394006 0.79 TDP1 (0.47) TDP1ALDH1A1HPGDBCL2L1HSD17B10
SCHEMBL28288272 0.79 TSHR (0.38) TDP1ALDH1A1MGLLTP53CYP3A4
SCHEMBL17667213 0.79 MGLL (0.46) TDP1MGLL
SCHEMBL17667218 0.78 HSPA5 (0.43) TDP1ALDH1A1HPGDBCL2L1HSD17B10

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
CN-106687526-B Composition epoxy resin is used in casting 株式会社钟化 2018-12-07 CN disclosed
CN-108699321-A Strengthening and Toughening composition epoxy resin 株式会社钟化 2018-10-23 CN disclosed
CN-106687526-A Epoxy resin composition for casting 株式会社钟化 2017-05-17 CN disclosed