SCHEMBL1685478

SCHEMBL1685478

CCc1cc(C)cc(CC)c1-c1c(CC(C)(C)C(=O)O)n2n(c1=O)CCOCC2

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ CNR2 P34972 10/20 0.33
▸ LMNA P02545 3/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CNR1 P21554 4/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL1685480 0.86 CNR2 (0.34) KDM4EL3MBTL1CNR2CNR1
SCHEMBL24213873 0.83 ALDH1A1 (0.33) KDM4ECNR2LMNARAB9ATP53
SCHEMBL1685479 0.83 KDM4E (0.36) KDM4EL3MBTL1LMNA
SCHEMBL5078713 0.77 HSD17B10 (0.38) LMNARAB9ATP53POLBALDH1A1
SCHEMBL24643264 0.76 MAPT (0.34) KDM4ELMNARAB9ATP53POLB
Pinoxaden SCHEMBL29359629 0.76 ELANE (0.33) CNR2LMNARAB9AALDH1A1MAPT
SCHEMBL22940089 0.75 MEN1 (0.30) CNR2ALDH1A1MAPTMAPK1CNR1
Pinoxaden SCHEMBL17187932 0.72 KMT2A (0.32) L3MBTL1CNR2ALDH1A1MAPTMAPK1
SCHEMBL22959624 0.70 RAB9A (0.34) KDM4EL3MBTL1CNR2LMNARAB9A
SCHEMBL14088267 0.69 SYK (0.33) KDM4ETP53POLBALDH1A1MEN1

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
EP-4364571-A1 HERBICIDE COMPOSITION, AND PREPARATION METHOD THEREFOR AND APPLICATION METHOD THEREOF Max (Rudong) Chemicals Co., Ltd. (CN) 2024-05-08 — — EP disclosed
US-20240081332-A1 HERBICIDE COMPOSITION AND PREPARATION METHOD AND APPLICATION METHOD THEREOF MAX RUDONG CHEMICALS CO LTD (CN) 2024-03-14 — — US disclosed
CN-117326976-A Synthesis method of 2, 6-diethyl-4-methylbenzene malononitrile 中国科学院大连化学物理研究所 2024-01-02 — — CN disclosed
EP-2970973-B1 METHODS AND COMPOSITIONS FOR WEED CONTROL MONSANTO TECHNOLOGY LLC (US) 2020-10-14 — — EP disclosed
WO-2018134439-A1 METHOD OF CONTROLLING WEEDS IN WARM SEASON TURFGRASS SYNGENTA PARTICIPATIONS AG (CH) 2018-07-26 — — WO disclosed
US-9414593-B2 Herbicidal compositions SYNGENTA CROP PROTECTION, LLC (US) 2016-08-16 — — US disclosed
US-20150175543-A1 SYNERGISTIC HERBICIDAL COMPOSITION CONTAINING CERTAIN PYRIDINE OR PYRIMIDINE CARBOXYLIC ACIDS AND CERTAIN CEREAL AND RICE HERBICIDES DOW AGROSCIENCES LLC 2015-06-25 — — US disclosed
US-8796177-B2 Herbicidal compositions comprising 4-amino-3-chloro-5-fluoro-6-(4-chloro-2-fluoro-3-methoxyphenyl)pyridine-2-carboxylic acid or a derivative thereof and acetyl-CoA carboxylase (ACCase) inhibitors DOW AGROSCIENCES LLC (US) 2014-08-05 — — US disclosed
US-20140031228-A1 HERBICIDAL COMPOSITIONS COMPRISING 4-AMINO-3-CHLORO-5-FLUORO-6-(4-CHLORO-2-FLUORO-3-METHOXYPHENYL) PYRIDINE-2-CARBOXYLIC ACID OR A DERIVATIVE THEREOF AND ACETYL-CoA CARBOXYLASE (ACCASE) INHIBITORS DOW AGROSCIENCES LLC (US) 2014-01-30 — — US disclosed
US-20110098178-A1 HERBICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-28 — — US disclosed
US-20080167188-A1 Herbicide Combinations Comprising Special Ketoenoles BAYER CROPSCIENCE AG (DE) 2008-07-10 — — 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-20140031228-A1 HERBICIDAL COMPOSITIONS COMPRISING 4-AMINO-3-CHLORO-5-FLUORO-6-(4-CHLORO-2-FLUORO-3-METHOXYPHENYL) PYRIDINE-2-CARBOXYLIC ACID OR A DERIVATIVE THEREOF AND ACETYL-CoA CARBOXYLASE (ACCASE) INHIBITORS DDT, ACACA, FAH KDM4E 504/4885L3MBTL1 1274/4885CNR2 2849/4885
US-20150175543-A1 SYNERGISTIC HERBICIDAL COMPOSITION CONTAINING CERTAIN PYRIDINE OR PYRIMIDINE CARBOXYLIC ACIDS AND CERTAIN CEREAL AND RICE HERBICIDES DHFR, DPYD, DDT KDM4E 1949/4885L3MBTL1 3821/4885CNR2 1682/4885
US-20080167188-A1 Herbicide Combinations Comprising Special Ketoenoles DDT, NOTUM, CA3 KDM4E 206/4885L3MBTL1 2475/4885CNR2 1453/4885

“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.

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