SCHEMBL7670906

SCHEMBL7670906

CN=C(SC)N(Cc1cccnc1)OC

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.46
CHRNA4 P43681 3/20 0.46
HTT P42858 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RIPK1 Q13546 1/20 0.39
CHRNA7 P36544 1/20 0.38
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38
LMNA P02545 1/20 0.37
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.36
TP53 P04637 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL7670900 1.00 CHRNB2 (0.46) CHRNB2CHRNA4HTTSMN1; SMN2RIPK1
SCHEMBL7662016 0.82 CHRNB2 (0.54) CHRNB2CHRNA4HTTSMN1; SMN2RIPK1
SCHEMBL7670410 0.80 CHRNB2 (0.42) CHRNB2CHRNA4HTTSMN1; SMN2CHRNA7
SCHEMBL7668729 0.80 KMT2A (0.48) CHRNB2CHRNA4HTTSMN1; SMN2LMNA
SCHEMBL7670648 0.80 CHRNB2 (0.53) CHRNB2CHRNA4HTTSMN1; SMN2RIPK1
SCHEMBL7668225 0.79 CHRNB2 (0.43) CHRNB2CHRNA4HTTSMN1; SMN2LMNA
SCHEMBL7669732 0.77 CHRNB2 (0.47) CHRNB2CHRNA4HTTSMN1; SMN2RIPK1
SCHEMBL10518385 0.75 TDP1 (0.48) CHRNB2CHRNA4HTTSMN1; SMN2RIPK1
SCHEMBL21342496 0.74 CHRNB2 (0.49) CHRNB2CHRNA4RIPK1LMNATRPM8
SCHEMBL7670729 0.74 CHRNA7 (0.56) CHRNB2CHRNA4HTTSMN1; SMN2CHRNA7

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