SCHEMBL7669309

SCHEMBL7669309

COCCN(C)C(=NCc1cccnc1)SC

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.40
CHRNB2 P17787 3/20 0.39
CHRNA4 P43681 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HTT P42858 1/20 0.39
KCNA5 P22460 2/20 0.38
KCNH2 Q12809 1/20 0.38
LTA4H P09960 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MAPK10 P53779 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
RIPK1 Q13546 1/20 0.36
HPGD P15428 1/20 0.35

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
SCHEMBL7669729 0.86 CHRNB2 (0.43) CHRNA7CHRNB2CHRNA4SMN1; SMN2HTT
SCHEMBL7664877 0.84 KMT2A (0.46) CHRNA7CHRNB2CHRNA4SMN1; SMN2HTT
SCHEMBL7658397 0.83 CHRNB2 (0.49) CHRNA7CHRNB2CHRNA4SMN1; SMN2HTT
SCHEMBL10512387 0.83 CHRNB2 (0.49) CHRNA7CHRNB2CHRNA4SMN1; SMN2HTT
SCHEMBL7662013 0.82 CHRNB2 (0.47) CHRNA7CHRNB2CHRNA4SMN1; SMN2HTT
SCHEMBL7668724 0.81 SMN1; SMN2 (0.51) CHRNB2CHRNA4SMN1; SMN2HTTALDH1A1
SCHEMBL7669313 0.81 CHRNB2 (0.46) CHRNA7CHRNB2CHRNA4SMN1; SMN2HTT
SCHEMBL7662170 0.79 LMNA (0.42) CHRNA7CHRNB2CHRNA4SMN1; SMN2HTT
SCHEMBL7669781 0.79 LMNA (0.50) CHRNA7CHRNB2CHRNA4SMN1; SMN2HTT
SCHEMBL7670898 0.77 SMN1; SMN2 (0.45) CHRNA7CHRNB2CHRNA4SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407248-B1 INSECTICIDES, MITICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-06-18 US disclosed
US-6124297-A COMBATTING INSECTS OR MITES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-09-26 US disclosed
US-5935981-A INSECTICIDAL/MITICIDAL ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-08-10 US disclosed
US-5849768-A α-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-12-15 US disclosed
EP-0529680-B1 Intermediates, their production and their use for preparing alpha-unsaturated amines TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-05-13 EP disclosed
EP-0302389-B1 Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-22 EP disclosed
US-5214152-A Insecticides, miticides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-05-25 US disclosed
EP-0529680-A2 Intermediates, their production and their use for preparing alpha-unsaturated amines TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-03-03 EP disclosed
US-5175301-A Insecticide, miticide, pesticide TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-29 US disclosed
EP-0509559-A2 Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-10-21 EP disclosed
EP-0310918-A2 Peptide-like amino-acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1989-04-12 EP disclosed
EP-0302389-A2 Alpha-unsaturated amines, their production and use Takeda Chemical Industries, Ltd. (JP) 1989-02-08 EP disclosed