Sugi Predict

Sugi Predict / Compounds / SCHEMBL509065

SCHEMBL509065

SCHEMBL509065

CCc1cc(CC)c(CC(=O)O)c(CC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 1/20 0.40
▸ RXRB P28702 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CAMK2A Q9UQM7 1/20 0.40
▸ ALDH1A1 P00352 5/20 0.39
▸ HPGD P15428 4/20 0.39
▸ HSD17B10 Q99714 4/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ MAPT P10636 2/20 0.39
▸ GAA P10253 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ AKR1B1 P15121 2/20 0.38
▸ THRB P10828 2/20 0.38
▸ TSHR P16473 2/20 0.37
▸ POLB P06746 2/20 0.36
▸ RGS12 O14924 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ APEX1 P27695 1/20 0.36

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
SCHEMBL509515 0.88 KDM4E (0.38) RXRARXRBCA2CAMK2AALDH1A1
SCHEMBL510120 0.83 MAPT (0.46) ALDH1A1HPGDKDM4EMAPTGAA
SCHEMBL509872 0.81 THRB (0.41) ALDH1A1HPGDHSD17B10KDM4EMAPT
Hydrochloric Acid SCHEMBL20740117 0.81 MAPT (0.45) ALDH1A1HPGDKDM4EMAPTGAA
SCHEMBL19475583 0.81 AGBL2 (0.41) RXRARXRBALDH1A1HPGDHSD17B10
SCHEMBL509958 0.81 PTGDR2 (0.46) ALDH1A1HPGDHSD17B10KDM4EAKR1B1
SCHEMBL509373 0.81 MEN1 (0.38) RXRARXRBALDH1A1HSD17B10KDM4E
SCHEMBL6491963 0.79 THRB (0.50) RXRARXRBCA2CAMK2AALDH1A1
SCHEMBL509824 0.78 HSD17B10 (0.54) RXRARXRBHSD17B10KDM4EMAPT
SCHEMBL4852417 0.77 RXRA (0.43) RXRARXRBALDH1A1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9096533-B2 Pyridazinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-08-04 — — US disclosed
US-9096534-B2 Pyridazinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-08-04 — — US disclosed
US-20150126738-A1 PYRIDAZINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2015-05-07 — — US disclosed
US-20150126739-A1 PYRIDAZINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2015-05-07 — — US disclosed
US-8962625-B2 Pyridazinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-02-24 — — US disclosed
US-8541414-B2 Pyridazinone compound and use thereof as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-09-24 — — US disclosed
US-8507410-B2 Pyridazinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-08-13 — — US disclosed
US-20120196750-A1 PYRIDAZINONE COMPOUND AND USE THEREOF KIJI TOSHIYUKI (JP) 2012-08-02 — — 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
US-20100298142-A1 HERBICIDAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-25 — — US disclosed
US-20100248964-A1 HERBICIDAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-30 — — US disclosed
WO-2010104217-A1 PYRIDAZINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-16 — — WO disclosed
US-20100210462-A1 HERBICIDAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-08-19 — — US disclosed
EP-1996557-B1 PYRIDAZINONE COMPOUND AND USE THEREOF AS HERBICIDES SUMITOMO CHEMICAL CO (JP) 2010-03-03 — — EP disclosed
US-20090111696-A1 Pyridazinone Compound and Use Thereof as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-30 — — US disclosed
WO-2009035146-A2 HERBICIDAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-03-19 — — WO disclosed
EP-1996557-A1 PYRIDAZINONE COMPOUND AND USE THEREOF AS HERBICIDES Sumitomo Chemical Company, Limited (JP) 2008-12-03 — — EP disclosed
WO-2007119434-A1 PYRIDAZINONE COMPOUND AND USE THEREOF AS HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-25 — — WO 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 (8 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 RXRA 995/4885RXRB 712/4885CA2 4416/4885
US-20100248964-A1 HERBICIDAL COMPOSITION CHRM2, CHRM1, WEE1 RXRA 976/4885RXRB 713/4885CA2 723/4885
US-20150126738-A1 PYRIDAZINONE COMPOUND AND USE THEREOF PDXK, PLPBP, PNPO RXRA 1113/4885RXRB 687/4885CA2 2424/4885
US-20100210462-A1 HERBICIDAL COMPOSITION WEE1, WEE2, H1-3 RXRA 1910/4885RXRB 1719/4885CA2 80/4885
US-20150126739-A1 PYRIDAZINONE COMPOUND AND USE THEREOF PDXK, PLPBP, PNPO RXRA 1113/4885RXRB 687/4885CA2 2424/4885
US-20120196750-A1 PYRIDAZINONE COMPOUND AND USE THEREOF PDXK, PLPBP, PNPO RXRA 1113/4885RXRB 687/4885CA2 2424/4885
US-20090111696-A1 Pyridazinone Compound and Use Thereof as herbicides PDXK, DDT, PLPBP RXRA 820/4885RXRB 536/4885CA2 2873/4885
US-20100298142-A1 HERBICIDAL COMPOSITION CYP2W1, WEE2, CYP2J2 RXRA 805/4885RXRB 832/4885CA2 958/4885

“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.