SCHEMBL5833192

SCHEMBL5833192

N#C/N=C1\NCCN1Cc1cnc(Cl)s1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
CHRNA7 P36544 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 3/20 0.38
RECQL P46063 1/20 0.38
GAA P10253 1/20 0.37
CHRNB2 P17787 2/20 0.33
CHRNA4 P43681 2/20 0.33
F10 P00742 1/20 0.32
PDE4B Q07343 2/20 0.32
PDE4D Q08499 1/20 0.32
MAPT P10636 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
SCHEMBL2755018 1.00 ALDH1A1 (0.40) ALDH1A1KMT2AMEN1CHRNA7TDP1
SCHEMBL5833852 0.93 LMNA (0.39) ALDH1A1KMT2AMEN1CHRNA7TDP1
SCHEMBL9070409 0.79 PDE4B (0.30) KMT2AMEN1CHRNA7TDP1PDE4B
SCHEMBL5833858 0.78 LMNA (0.39) ALDH1A1KMT2AMEN1CHRNA7TDP1
Imidaclothiz SCHEMBL676082 0.78 CHRNB2 (0.55) ALDH1A1KMT2AMEN1CHRNA7LMNA
Imidaclothiz SCHEMBL238122 0.78 CHRNB2 (0.55) ALDH1A1KMT2AMEN1CHRNA7LMNA
SCHEMBL19975726 0.77 CHRNA7 (0.61) ALDH1A1KMT2AMEN1CHRNA7TDP1
SCHEMBL5833216 0.77 CHRNA7 (0.61) ALDH1A1KMT2AMEN1CHRNA7TDP1
SCHEMBL5833213 0.77 CHRNA7 (0.61) ALDH1A1KMT2AMEN1CHRNA7TDP1
SCHEMBL31633994 0.76 ALDH1A1 (0.47) ALDH1A1KMT2AMEN1LMNARECQL

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE39140-E1 Heterocyclic compounds BAYER CROPSCIENCE K.K. (JP) 2006-06-20 US claimed
US-RE39127-E1 Heterocyclic compounds BAYER CROPSCIENCE K.K. (JP) 2006-06-13 US claimed
US-RE39129-E1 Heterocyclic compounds BAYER CROPSCIENCE K.K. (JP) 2006-06-13 US claimed
US-RE39131-E1 Heterocyclic compounds BAYER CROPSCIENCE K.K. (JP) 2006-06-13 US claimed
US-RE39130-E1 Heterocyclic compounds BAYER CROPSCIENCE K.K. (JP) 2006-06-13 US claimed
EP-0431361-B1 Use of stabilizers for agrochemical compositions BAYER AGROCHEM KK (JP) 1994-02-23 EP claimed
EP-0431362-B1 Stabilized agrochemical compositions BAYER AGROCHEM KK (JP) 1993-11-03 EP claimed
EP-0235725-B1 HETEROCYCLIC COMPOUNDS NIHON BAYER AGROCHEM K.K. (JP) 1991-11-21 EP claimed
EP-0431361-A1 Use of stabilizers for agrochemical compositions NIHON BAYER AGROCHEM K.K. (JP) 1991-06-12 EP claimed
EP-0431362-A1 Stabilized agrochemical compositions NIHON BAYER AGROCHEM K.K. (JP) 1991-06-12 EP claimed
EP-0235725-A2 Heterocyclic compounds NIHON BAYER AGROCHEM K.K. (JP) 1987-09-09 EP claimed
US-RE39140-E1 Heterocyclic compounds BAYER CROPSCIENCE K.K. (JP) 2006-06-20 US disclosed
US-RE39129-E1 Heterocyclic compounds BAYER CROPSCIENCE K.K. (JP) 2006-06-13 US disclosed
US-RE39131-E1 Heterocyclic compounds BAYER CROPSCIENCE K.K. (JP) 2006-06-13 US disclosed
US-RE39130-E1 Heterocyclic compounds BAYER CROPSCIENCE K.K. (JP) 2006-06-13 US disclosed
EP-0235725-B1 HETEROCYCLIC COMPOUNDS NIHON BAYER AGROCHEM K.K. (JP) 1991-11-21 EP disclosed
EP-0431361-A1 Use of stabilizers for agrochemical compositions NIHON BAYER AGROCHEM K.K. (JP) 1991-06-12 EP disclosed
EP-0431362-A1 Stabilized agrochemical compositions NIHON BAYER AGROCHEM K.K. (JP) 1991-06-12 EP disclosed
US-4849432-A INSECTICIDES NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1989-07-18 US disclosed
EP-0235725-A2 Heterocyclic compounds NIHON BAYER AGROCHEM K.K. (JP) 1987-09-09 EP disclosed