SCHEMBL7209299

SCHEMBL7209299

C[Si](C)(C)Cl.C[Si](C)(C)NC(=O)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.40
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
EPHX1 P07099 1/20 0.32
CA3 P07451 2/20 0.30
CA5A P35218 2/20 0.30
CA5B Q9Y2D0 2/20 0.30
CA12 O43570 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 1/20 0.30
CA14 Q9ULX7 1/20 0.30

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
SCHEMBL248291 0.93 CA2 (0.46) CA2ALDH1A1POLBSMN1; SMN2MEN1
Water SCHEMBL27649766 0.90 CA2 (0.43) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL31271881 0.78 CA2 (0.31) CA2
SCHEMBL31271971 0.78 MAPK8 (0.34) CA2
Pyridine SCHEMBL9828025 0.77 L3MBTL1 (0.35) CA2MEN1KMT2AL3MBTL1
SCHEMBL31272379 0.74
SCHEMBL31272451 0.74
SCHEMBL31272372 0.74
SCHEMBL31272146 0.74
SCHEMBL31272355 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118067879-A Method for measuring dicamba in organic tea 镇江高等职业技术学校 2024-05-24 CN disclosed
CN-116376738-A Endophyte Serratia Wed4 and application thereof in polycyclic aromatic hydrocarbon degradation and nitrogen fixation 南京农业大学 2023-07-04 CN disclosed
EP-1309698-A2 A CYTOCHROME P450 ENZYME ASSOCIATED WITH THE SYNTHESIS OF DELTA-12 -EPOXY GROUPS IN FATTY ACIDS OF PLANTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2003-05-14 EP disclosed
WO-2002008269-A2 A CYTOCHROME P450 ENZYME ASSOCIATED WITH THE SYNTHESIS OF Δ12-EPOXY GROUPS IN FATTY ACIDS OF PLANTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2002-01-31 WO disclosed