SCHEMBL28516402

SCHEMBL28516402

Cc1ccc2c(c1C)C(=O)N(Cc1ccccc1)S2(=O)=O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA12 O43570 14/20 0.57
CA9 Q16790 14/20 0.57
RAB9A P51151 1/20 0.49
CA1 P00915 6/20 0.49
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
GAA P10253 1/20 0.43
CA2 P00918 4/20 0.43
HSD11B1 P28845 1/20 0.42
ELANE P08246 1/20 0.41

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
SCHEMBL1172438 0.73 CA12 (1.00) CA12CA9CA1KMT2ATDP1
SCHEMBL30527996 0.73 CA12 (1.00) CA12CA9CA1KMT2ATDP1
Ammonia Solution, Strong SCHEMBL27564485 0.73 CA12 (0.47) CA12CA9RAB9ACA1KMT2A
SCHEMBL7280904 0.72 ELANE (0.56) CA12CA9RAB9ACA1ELANE
SCHEMBL2927307 0.70 CA12 (0.43) CA12CA9RAB9ACA1KMT2A
SCHEMBL7290598 0.70 ELANE (0.50) CA12CA9RAB9ACA1ELANE
SCHEMBL6242464 0.70 CA12 (0.68) CA12CA9RAB9ACA1KMT2A
SCHEMBL7314445 0.70 CA12 (0.68) CA12CA9RAB9ACA1KMT2A
SCHEMBL9821407 0.70 CA12 (0.52) CA12CA9RAB9ACA1KMT2A
SCHEMBL31455616 0.69 CA12 (1.00) CA12CA9RAB9ACA1KMT2A

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-112566885-A Novel crop nutrition and fortification compositions 阿鲁恩·维塔尔·沙旺特 2021-03-26 CN disclosed
CN-112204000-A Novel crop nutrition and fortification compositions 阿鲁恩·维塔尔·沙旺特 2021-01-08 CN disclosed