SCHEMBL7664429

SCHEMBL7664429

CCC/N=C\c1cccnc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
KMT2A Q03164 2/20 0.49
G6PC1 P35575 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 3/20 0.45
MAPT P10636 3/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
CTH P32929 1/20 0.44
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
POLB P06746 1/20 0.43
MAPK1 P28482 1/20 0.43
TSHR P16473 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43

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
SCHEMBL7664431 1.00 ALDH1A1 (0.58) ALDH1A1KMT2AG6PC1SMN1; SMN2LMNA
SCHEMBL7119990 0.90 ALDH1A1 (0.55) ALDH1A1G6PC1SMN1; SMN2LMNAMAPT
SCHEMBL7119993 0.90 ALDH1A1 (0.55) ALDH1A1G6PC1SMN1; SMN2LMNAMAPT
SCHEMBL4253302 0.89 ALDH1A1 (0.67) ALDH1A1KMT2AG6PC1SMN1; SMN2LMNA
SCHEMBL4253299 0.89 ALDH1A1 (0.67) ALDH1A1KMT2AG6PC1SMN1; SMN2LMNA
SCHEMBL7665544 0.85 ALDH1A1 (0.62) ALDH1A1KMT2AG6PC1SMN1; SMN2LMNA
SCHEMBL7665538 0.85 ALDH1A1 (0.62) ALDH1A1KMT2AG6PC1SMN1; SMN2LMNA
SCHEMBL4253696 0.84 ALDH1A1 (0.60) ALDH1A1KMT2AG6PC1SMN1; SMN2LMNA
SCHEMBL4253702 0.84 ALDH1A1 (0.60) ALDH1A1KMT2AG6PC1SMN1; SMN2LMNA
SCHEMBL7666661 0.81 ALDH1A1 (0.58) ALDH1A1KMT2AG6PC1SMN1; SMN2LMNA

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