SCHEMBL22322834

SCHEMBL22322834

Cc1nncc(-c2cc[n+](CCC(=O)Cl)cc2)n1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 1/20 0.32
▸ TERT O14746 1/20 0.32

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
SCHEMBL22340392 0.88 KDM4E (0.35) CYP11B2TERT
SCHEMBL22322859 0.88 ALDH1A1 (0.31) CYP11B2
Hydrochloric Acid SCHEMBL22322837 0.86 KDM4E (0.35) TERT
SCHEMBL22340380 0.85 LTB4R (0.34) CYP11B2TERT
SCHEMBL22340393 0.83 LTB4R (0.33) —
SCHEMBL22340811 0.81 NPC1 (0.32) —
Hydrochloric Acid SCHEMBL22322860 0.80 ACHE (0.32) —
Trifluoroacetic Acid SCHEMBL22322806 0.78 SMN1; SMN2 (0.34) CYP11B2
SCHEMBL22340705 0.77 ALDH1A1 (0.38) CYP11B2
SCHEMBL22322810 0.76 KDM4E (0.34) CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020161162-A1 HERBICIDAL PYRIDINIUM COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2020-08-13 — — WO disclosed
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