SCHEMBL28864441

SCHEMBL28864441

COC(=O)C(=O)Oc1ccccc1COc1ccccc1C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.48
RXRB P28702 1/20 0.48
RXRG P48443 1/20 0.48
NPSR1 Q6W5P4 1/20 0.47
RECQL P46063 1/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.46
CDK4 P11802 1/20 0.46
CCND1 P24385 1/20 0.46
ALDH1A1 P00352 1/20 0.45
CYP1A2 P05177 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NOTUM Q6P988 1/20 0.44
POLB P06746 2/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SLC1A5 Q15758 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SGMS2 Q8NHU3 1/20 0.42

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
SCHEMBL7694447 0.86 NPSR1 (0.46) RXRARXRBRXRGNPSR1RECQL
SCHEMBL7694445 0.84 NPSR1 (0.44) RXRARXRBRXRGNPSR1RECQL
SCHEMBL7694443 0.84 NPSR1 (0.44) RXRARXRBRXRGNPSR1RECQL
SCHEMBL5338820 0.83 RXRA (0.51) RXRARXRBRXRGNPSR1RECQL
SCHEMBL8617222 0.82 CDK4 (0.44) RXRARXRBRXRGNPSR1RECQL
SCHEMBL8848536 0.81 RXRA (0.47) RXRARXRBRXRGNPSR1RECQL
SCHEMBL8014179 0.81 PTGDR2 (0.54) RXRARXRBRXRGNPSR1RECQL
SCHEMBL29787364 0.81 RXRA (0.47) RXRARXRBRXRGNPSR1RECQL
SCHEMBL27460967 0.81 RXRA (0.49) RXRARXRBRXRGNPSR1RECQL
SCHEMBL8622048 0.80 TDP1 (0.41) RXRARXRBRXRGNPSR1RECQL

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
CN-117263208-A Recovery method of by-product ammonium chloride in kresoxim-methyl production process 江西欧氏化工有限公司 2023-12-22 CN disclosed
CN-110396054-B Green synthesis method of kresoxim-methyl 京博农化科技有限公司 2022-09-20 CN disclosed