SCHEMBL28079362

SCHEMBL28079362

CCOCC(=O)OC(=O)Cl

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
TSHR P16473 1/20 0.33
SOAT1 P35610 1/20 0.33
TRPA1 O75762 1/20 0.31
HPGD P15428 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
SCHEMBL7102467 0.85 ALDH1A1 (0.46) ALDH1A1MGAMGAASIMGAM2
SCHEMBL28176095 0.78 FFAR3 (0.36) ALDH1A1MGAMGAASIMGAM2
SCHEMBL585566 0.78 ALDH1A1 (0.44) ALDH1A1MGAMGAASIMGAM2
SCHEMBL984996 0.76
SCHEMBL5908792 0.76 ALDH1A1 (0.39) ALDH1A1MGAMGAASIMGAM2
SCHEMBL8982522 0.76 ALDH1A1 (0.39) ALDH1A1MGAMGAASIMGAM2
SCHEMBL28876500 0.76 ALOX15 (0.44) ALDH1A1MGAMGAASIMGAM2
SCHEMBL9416719 0.75
SCHEMBL316214 0.74
SCHEMBL28556120 0.74 MGAM (0.39) ALDH1A1MGAMGAASIMGAM2

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-106164070-A There is the macro ring picolinamide compound of Fungicidally active 美国陶氏益农公司 2016-11-23 CN disclosed
CN-105764897-A Use of macrocylic picolinamides as fungicides 美国陶氏益农公司 2016-07-13 CN disclosed