SCHEMBL16093059

SCHEMBL16093059

CN1CCCN(Cc2cnc(Cl)s2)/C1=N/[N+](=O)[O-]

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
LMNA P02545 4/20 0.39
KMT2A Q03164 2/20 0.39
RECQL P46063 2/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 3/20 0.36
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
PKM P14618 1/20 0.33
CHRNB2 P17787 2/20 0.32
CHRNA4 P43681 2/20 0.32
PARG Q86W56 2/20 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
SCHEMBL18623488 0.93 ALDH1A1 (0.43) ALDH1A1LMNAKMT2ARECQLGAA
SCHEMBL13168806 0.93 ALDH1A1 (0.43) ALDH1A1LMNAKMT2ARECQLGAA
SCHEMBL5194395 0.84 LMNA (0.38) ALDH1A1LMNAKMT2ARECQLGAA
SCHEMBL5194388 0.84 LMNA (0.38) ALDH1A1LMNAKMT2ARECQLGAA
SCHEMBL45484 0.84 LMNA (0.38) ALDH1A1LMNAKMT2ARECQLGAA
Thiamethoxam SCHEMBL3956094 0.84 LMNA (0.38) ALDH1A1LMNAKMT2ARECQLGAA
Thiamethoxam SCHEMBL22916 0.84 LMNA (0.38) ALDH1A1LMNAKMT2ARECQLGAA
SCHEMBL515504 0.84 LMNA (0.38) ALDH1A1LMNAKMT2ARECQLGAA
Thiamethoxam SCHEMBL22918 0.84 LMNA (0.38) ALDH1A1LMNAKMT2ARECQLGAA
Thiamethoxam SCHEMBL22917 0.84 LMNA (0.38) ALDH1A1LMNAKMT2ARECQLGAA

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
US-8841294-B2 Active ingredient combinations having insecticidal and acaricidal properties BAYER CROPSCIENCE AG (DE) 2014-09-23 US disclosed
US-8841294-B2 Active ingredient combinations having insecticidal and acaricidal properties BAYER CROPSCIENCE AG (DE) 2014-09-23 US disclosed