SCHEMBL407628

SCHEMBL407628

Clc1ccc2cn[c]nc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.41
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
DYRK1A Q13627 2/20 0.37
NOS1 P29475 2/20 0.37
F7 P08709 1/20 0.36
F3 P13726 1/20 0.36
PIK3CG P48736 1/20 0.36
CYP2A6 P11509 1/20 0.35
CMA1 P23946 1/20 0.35
AHR P35869 1/20 0.35
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
THRB P10828 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
POLB P06746 1/20 0.35
HTR3A P46098 2/20 0.33
BACE1 P56817 1/20 0.33

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
SCHEMBL404311 0.84 HTR3A (0.41) NR4A2DYRK1ANOS1F7F3
SCHEMBL406493 0.76 BACE1 (0.42) DYRK1ANOS1CYP2A6AHRMAPT
SCHEMBL406789 0.76 BACE1 (0.41) PDGFRBPDGFRACYP2A6AHRMAPT
SCHEMBL2303882 0.76 CYP1A2 (0.45) CYP2A6MAPTLMNACYP1A2POLB
SCHEMBL5342100 0.75 MAPK13 (0.34) PDGFRBPDGFRADYRK1AMAPTPOLB
SCHEMBL407150 0.72 BACE1 (0.46) DYRK1AMAPTLMNABACE1KDM4E
SCHEMBL5337105 0.72 EGFR (0.53) PDGFRBPDGFRACYP2A6LMNACYP1A2
SCHEMBL3661273 0.71 KDM4E (0.48) NR4A2PDGFRBPDGFRADYRK1ANOS1
SCHEMBL3032 0.70 ALDH1A1 (0.44) MAPTCYP1A2HTR3ABACE1HRH4
SCHEMBL207987 0.69 NR4A2 (0.47) NR4A2PDGFRBPDGFRADYRK1ANOS1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2389066-B1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LTD (GB) 2017-07-05 EP claimed
EP-2387569-B1 HERBCIDES SYNGENTA LTD (GB) 2016-06-15 EP claimed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US claimed
US-8865623-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and method of controlling weeds SYNGENTA LIMITED (GB) 2014-10-21 US claimed
US-20030216571-A1 Antiallergens; antiinflammatory agents UBE INDUSTRIES, LTD. (JP) 2003-11-20 US claimed
EP-1254897-A1 TRICYCLIC COMPOUNDS Ube Industries, Ltd. (JP) 2002-11-06 EP claimed
EP-2389066-B1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LTD (GB) 2017-07-05 EP disclosed
EP-2387569-B1 HERBCIDES SYNGENTA LTD (GB) 2016-06-15 EP disclosed
US-9102642-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and methods of controlling weeds SYNGENTA LIMITED (GB) 2015-08-11 US disclosed
EP-2393796-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2015-02-25 EP disclosed
US-20140378305-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2014-12-25 US disclosed
EP-2393769-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2014-12-10 EP disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-20120021912-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
US-20120021909-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
US-7309718-B2 Dibenzocycloheptene compound UBE INDUSTRIES, LTD. (JP) 2007-12-18 US disclosed
US-20040180884-A1 Dibenzocycloheptene compound UBE INDUSTRIES, LTD. (JP) 2004-09-16 US disclosed
EP-1408033-A1 DIBENZOCYCLOHEPTENE COMPOUND Ube Industries, Ltd. (JP) 2004-04-14 EP disclosed
US-20030216571-A1 Antiallergens; antiinflammatory agents UBE INDUSTRIES, LTD. (JP) 2003-11-20 US disclosed
EP-1254897-A1 TRICYCLIC COMPOUNDS Ube Industries, Ltd. (JP) 2002-11-06 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120021912-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 NR4A2 718/4885PDGFRB 3791/4885PDGFRA 3654/4885
US-20040180884-A1 Dibenzocycloheptene compound LTB4R2, LTA4H, LTC4S NR4A2 245/4885PDGFRB 2703/4885PDGFRA 3711/4885
US-20120021909-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 NR4A2 718/4885PDGFRB 3791/4885PDGFRA 3654/4885
US-20140378305-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 NR4A2 933/4885PDGFRB 3452/4885PDGFRA 3334/4885
US-20030216571-A1 Antiallergens; antiinflammatory agents CYSLTR2, CYSLTR1, LTC4S NR4A2 710/4885PDGFRB 3970/4885PDGFRA 3950/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.