SCHEMBL9866741

SCHEMBL9866741

CN1CN/C(=N/[N+](=O)[O-])N(Cc2cnc(Cl)s2)C1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.38
CHRNA4 P43681 2/20 0.38
LMNA P02545 3/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.32
RECQL P46063 2/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
PKM P14618 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
SCHEMBL9866750 1.00 CHRNB2 (0.38) CHRNB2CHRNA4LMNAALDH1A1GAA
SCHEMBL13654231 1.00 CHRNB2 (0.38) CHRNB2CHRNA4LMNAALDH1A1GAA
Imidaclothiz SCHEMBL676082 0.81 CHRNB2 (0.55) CHRNB2CHRNA4LMNAALDH1A1GAA
Imidaclothiz SCHEMBL238122 0.81 CHRNB2 (0.55) CHRNB2CHRNA4LMNAALDH1A1GAA
Desmethylthiamethoxam SCHEMBL7173902 0.81 CHRNB2 (0.40) CHRNB2CHRNA4LMNAALDH1A1GAA
SCHEMBL515504 0.81 LMNA (0.38) CHRNB2CHRNA4LMNAALDH1A1GAA
SCHEMBL45483 0.81 LMNA (0.38) CHRNB2CHRNA4LMNAALDH1A1GAA
SCHEMBL45484 0.81 LMNA (0.38) CHRNB2CHRNA4LMNAALDH1A1GAA
Desmethylthiamethoxam SCHEMBL6445790 0.81 CHRNB2 (0.40) CHRNB2CHRNA4LMNAALDH1A1GAA
Desmethylthiamethoxam SCHEMBL6445785 0.81 CHRNB2 (0.40) CHRNB2CHRNA4LMNAALDH1A1GAA

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
US-5032589-A Insecticidal heterocyclic compounds NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1991-07-16 US claimed