SCHEMBL7670904

SCHEMBL7670904

CSC(=NC(C)C)N(C)Cc1cccnc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
CHRNB2 P17787 2/20 0.50
CHRNA4 P43681 2/20 0.50
RIPK1 Q13546 1/20 0.47
NAMPT P43490 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 1/20 0.42
CHRNA7 P36544 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
ACACB O00763 1/20 0.40
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL7662016 0.85 CHRNB2 (0.54) LMNACHRNB2CHRNA4RIPK1NAMPT
SCHEMBL7658401 0.82 CHRNB2 (0.53) LMNACHRNB2CHRNA4RIPK1NAMPT
SCHEMBL10482678 0.80 CHRNB2 (0.49) LMNACHRNB2CHRNA4RIPK1NAMPT
SCHEMBL7669781 0.80 LMNA (0.50) LMNACHRNB2CHRNA4RIPK1NAMPT
SCHEMBL7664882 0.78 CHRNB2 (0.48) LMNACHRNB2CHRNA4RIPK1NAMPT
SCHEMBL7662172 0.78 CHRNB2 (0.47) LMNACHRNB2CHRNA4RIPK1NAMPT
SCHEMBL7668724 0.77 SMN1; SMN2 (0.51) LMNACHRNB2CHRNA4RIPK1NAMPT
SCHEMBL7669313 0.77 CHRNB2 (0.46) LMNACHRNB2CHRNA4RIPK1NAMPT
SCHEMBL27287571 0.76 CHRNB2 (0.57) LMNACHRNB2CHRNA4RIPK1NAMPT
SCHEMBL7658397 0.74 CHRNB2 (0.49) LMNACHRNB2CHRNA4RIPK1SMN1; SMN2

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