SCHEMBL7667283

SCHEMBL7667283

CS/C(=C\[N+](=O)[O-])NCc1ccc(Cl)nc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.48
MAPT P10636 8/20 0.48
HTT P42858 2/20 0.48
NAMPT P43490 2/20 0.43
CYP2C9 P11712 2/20 0.43
FAAH O00519 1/20 0.43
LMNA P02545 2/20 0.43
CHRNB2 P17787 2/20 0.41
CHRNA4 P43681 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
KDM4E B2RXH2 2/20 0.40
GAA P10253 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
CHRNA1 P02708 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA7 P36544 1/20 0.38

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
SCHEMBL7667286 1.00 ALDH1A1 (0.48) ALDH1A1MAPTHTTNAMPTCYP2C9
SCHEMBL9046373 0.85 ALDH1A1 (0.44) ALDH1A1MAPTHTTNAMPTLMNA
SCHEMBL7663609 0.83 CYP2C9 (0.44) ALDH1A1MAPTNAMPTCYP2C9FAAH
SCHEMBL7665411 0.83 ALDH1A1 (0.65) ALDH1A1MAPTHTTCYP2C9LMNA
SCHEMBL7665405 0.83 ALDH1A1 (0.65) ALDH1A1MAPTHTTCYP2C9LMNA
SCHEMBL10354495 0.82 ALDH1A1 (0.41) ALDH1A1MAPTHTTCYP2C9LMNA
SCHEMBL10354496 0.82 ALDH1A1 (0.41) ALDH1A1MAPTHTTCYP2C9LMNA
SCHEMBL9047024 0.82 FPR2 (0.44) ALDH1A1MAPTNAMPTCYP2C9FAAH
SCHEMBL9047032 0.82 FPR2 (0.44) ALDH1A1MAPTNAMPTCYP2C9FAAH
SCHEMBL9044324 0.81 MAPT (0.48) 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