SCHEMBL509959

SCHEMBL509959

CCc1[c]c(Cl)cc(-c2ccccc2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.35
CRHBP P24387 1/20 0.34
CRHR2 Q13324 1/20 0.34
ALDH1A1 P00352 5/20 0.33
SMN1; SMN2 Q16637 5/20 0.33
KDM4E B2RXH2 2/20 0.33
HTT P42858 2/20 0.33
POLB P06746 1/20 0.33
ESR2 Q92731 1/20 0.32
TP53 P04637 1/20 0.32
AKR1C2 P52895 1/20 0.32
AKR1C1 Q04828 1/20 0.32
L3MBTL1 Q9Y468 3/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.31
FTO Q9C0B1 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
HPGD P15428 2/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL510173 0.86 ALDH1A1 (0.41) CRHBPCRHR2ALDH1A1SMN1; SMN2KDM4E
SCHEMBL15287281 0.85 AHR (0.41) CYP1A2ALDH1A1SMN1; SMN2KDM4EHTT
SCHEMBL1068381 0.80 CYP1A2 (0.48) CYP1A2CRHBPCRHR2ALDH1A1SMN1; SMN2
SCHEMBL27522805 0.78 CYP1A2 (0.46) CYP1A2CRHBPCRHR2ALDH1A1SMN1; SMN2
SCHEMBL455425 0.75 MAPT (0.34) CYP1A2CRHBPCRHR2ALDH1A1SMN1; SMN2
SCHEMBL1068489 0.75 CYP1A2 (0.39) CYP1A2CRHBPCRHR2ALDH1A1SMN1; SMN2
SCHEMBL509857 0.75 AHR (0.45) CYP1A2ALDH1A1SMN1; SMN2KDM4EHTT
SCHEMBL721411 0.75 TP53 (0.36) ALDH1A1SMN1; SMN2TP53L3MBTL1MAPT
SCHEMBL459062 0.74 PYCR1 (0.35) CRHBPCRHR2ALDH1A1L3MBTL1MAPT
SCHEMBL15287092 0.73 AHR (0.49) CYP1A2ALDH1A1SMN1; SMN2MAPK1HPGD

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507410-B2 Pyridazinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-08-13 US disclosed
US-8470738-B2 Pyridazinone compound and herbicide containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-06-25 US disclosed
US-20120028988-A1 USE OF PYRIDAZINONE COMPOUND FOR CONTROL OF HARMFUL ARTHROPOD PESTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-02 US disclosed
US-20120028803-A1 PYRIDAZINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-02 US disclosed
EP-2406232-A1 PYRIDAZINONE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2012-01-18 EP disclosed
EP-2188264-B1 PYRIDAZINONE COMPOUND AND HERBICIDE CONTAINING THE SAME SUMITOMO CHEMICAL CO (JP) 2011-03-23 EP disclosed
WO-2010104217-A1 PYRIDAZINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-16 WO disclosed
US-20100216642-A1 PYRIDAZINONE COMPOUND AND HERBICIDE CONTAINING THE SAME SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-08-26 US 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 (3 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-20120028803-A1 PYRIDAZINONE COMPOUND AND USE THEREOF C5, C1S, WEE1 CYP1A2 56/4885CRHBP 2421/4885CRHR2 1450/4885
US-20100216642-A1 PYRIDAZINONE COMPOUND AND HERBICIDE CONTAINING THE SAME WEE1, WEE2, CBR3 CYP1A2 26/4885CRHBP 3567/4885CRHR2 978/4885
US-20120028988-A1 USE OF PYRIDAZINONE COMPOUND FOR CONTROL OF HARMFUL ARTHROPOD PESTS PLPBP, PNPO, PIR CYP1A2 55/4885CRHBP 3560/4885CRHR2 4708/4885

“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.