SCHEMBL7665405

SCHEMBL7665405

CS/C(=C\[N+](=O)[O-])NCc1ccc(Cl)cc1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.65
MAPT P10636 7/20 0.65
HTT P42858 2/20 0.65
LMNA P02545 4/20 0.48
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
HPGD P15428 3/20 0.45
CYP2C19 P33261 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CYP2C9 P11712 1/20 0.44
TP53 P04637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL7665411 1.00 ALDH1A1 (0.65) ALDH1A1MAPTHTTLMNAMEN1
SCHEMBL7667283 0.83 ALDH1A1 (0.48) ALDH1A1MAPTHTTLMNACYP2C19
SCHEMBL7667286 0.83 ALDH1A1 (0.48) ALDH1A1MAPTHTTLMNACYP2C19
SCHEMBL9044324 0.82 MAPT (0.48) ALDH1A1MAPTHTTLMNASMN1; SMN2
SCHEMBL28283919 0.80 MEN1 (0.54) ALDH1A1MAPTHTTLMNAMEN1
SCHEMBL7663833 0.79 CYP2C19 (0.57) ALDH1A1MAPTHTTLMNAMEN1
SCHEMBL7663828 0.79 CYP2C19 (0.57) ALDH1A1MAPTHTTLMNAMEN1
SCHEMBL7665652 0.78 MEN1 (0.49) ALDH1A1MAPTHTTLMNAMEN1
SCHEMBL7665650 0.78 MEN1 (0.49) ALDH1A1MAPTHTTLMNAMEN1
SCHEMBL9046373 0.78 ALDH1A1 (0.44) ALDH1A1MAPTHTTLMNASMN1; 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