SCHEMBL2320176

SCHEMBL2320176

COc1cc(OC)nc(NC(=O)NS(=O)(=O)N(C)S(C)(=O)=O)n1.[NaH]

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.57
CYP1A2 P05177 1/20 0.50
CDK1 P06493 1/20 0.50
MAPT P10636 2/20 0.43
TP53 P04637 1/20 0.43
GLA P06280 1/20 0.43
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL54922 0.99 GAA (0.58) GAACYP1A2CDK1MAPTTP53
SCHEMBL8347834 0.99 GAA (0.58) GAACYP1A2CDK1MAPTTP53
SCHEMBL9621633 0.91 GAA (0.51) GAACYP1A2CDK1MAPTLMNA
SCHEMBL7157074 0.90 GAA (0.57) GAACYP1A2CDK1MAPTTP53
SCHEMBL6906049 0.86 GAA (0.56) GAACYP1A2CDK1MAPTTP53
SCHEMBL28063785 0.82 GAA (0.46) GAACYP1A2CDK1MAPTTP53
SCHEMBL8676026 0.82 GAA (0.63) GAACYP1A2CDK1MAPTTP53
SCHEMBL4451216 0.81 FBP1 (0.41) GAACYP1A2CDK1MAPTTP53
SCHEMBL7800046 0.80 GAA (0.61) GAACYP1A2CDK1MAPTTP53
SCHEMBL8781452 0.80 GAA (0.55) GAACYP1A2CDK1MAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101282641-B Diflufenican-containing oil suspension concentrates BAYER CROPSCIENCE AG 2012-08-29 CN claimed
EP-1951049-B1 DIFLUFENICAN-CONTAINING OIL SUSPENSION CONCENTRATES BAYER CROPSCIENCE AG (DE) 2011-08-10 EP claimed
CN-101282641-A Diflufenican-containing oil suspension concentrates BAYER CROPSCIENCE AG (DE) 2008-10-08 CN claimed
CN-116568137-A Compositions comprising mesosulfuron and TEHP 拜耳公司 2023-08-08 CN disclosed
US-10194663-B2 Chemical stabilization of iodosulfuron-methyl sodium salt by hydroxystearates BAYER CROPSCIENCE AG (DE) 2019-02-05 US disclosed
US-20170339959-A1 CHEMICAL STABILIZATION OF IODOSULFURON-METHYL SODIUM SALT BY HYDROXYSTEARATES BAYER CROPSCIENCE AG (DE) 2017-11-30 US disclosed
US-9763450-B2 Chemical stabilization of iodosulfuron-methyl sodium salt by hydroxystearates BAYER CROPSCIENCE AG (DE) 2017-09-19 US disclosed
US-20150105259-A1 CHEMICAL STABILIZATION OF IODOSULFURON-METHYL SODIUM SALT BY HYDROXYSTEARATES BAYER CROPSCIENCE AG (DE) 2015-04-16 US disclosed