SCHEMBL7664877

SCHEMBL7664877

CCCCN(C)C(=NCc1cccnc1)SC

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 2/20 0.43
CHRNB2 P17787 2/20 0.41
CHRNA4 P43681 2/20 0.41
CHRNA7 P36544 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
HTT P42858 2/20 0.39
RIPK1 Q13546 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPK10 P53779 1/20 0.38
HSD17B10 Q99714 1/20 0.38
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.37
NPC1 O15118 1/20 0.37
FAAH O00519 1/20 0.37

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 0.92 CHRNB2 (0.43) KMT2ATDP1L3MBTL1MAPTCHRNB2
SCHEMBL7658397 0.87 CHRNB2 (0.49) KMT2ATDP1L3MBTL1MAPTCHRNB2
SCHEMBL10512387 0.87 CHRNB2 (0.49) KMT2ATDP1L3MBTL1MAPTCHRNB2
SCHEMBL7669309 0.84 CHRNA7 (0.40) TDP1L3MBTL1CHRNB2CHRNA4CHRNA7
SCHEMBL7662013 0.83 CHRNB2 (0.47) CHRNB2CHRNA4CHRNA7SMN1; SMN2HTT
SCHEMBL7668724 0.82 SMN1; SMN2 (0.51) CHRNB2CHRNA4SMN1; SMN2HTTRIPK1
SCHEMBL8405283 0.80 CHRNB2 (0.46) TDP1L3MBTL1MAPTCHRNB2CHRNA4
SCHEMBL7664882 0.80 CHRNB2 (0.48) KMT2ATDP1L3MBTL1MAPTCHRNB2
SCHEMBL7662170 0.80 LMNA (0.42) CHRNB2CHRNA4CHRNA7SMN1; SMN2HTT
SCHEMBL7669781 0.80 LMNA (0.50) CHRNB2CHRNA4CHRNA7SMN1; 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 11 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-0302389-A2 Alpha-unsaturated amines, their production and use Takeda Chemical Industries, Ltd. (JP) 1989-02-08 EP disclosed