SCHEMBL10002120

SCHEMBL10002120

CC[n+]1ccc(-c2ccc(-c3cc[n+](CCP(=O)(O)O)cc3)o2)cc1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NQO2 P16083 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ GGPS1 O95749 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL13076925 0.90 NQO2 (0.33) NQO2MEN1TP53CYP1A2CYP2D6
SCHEMBL9889761 0.87 MEN1 (0.41) MEN1TP53CYP1A2CYP2D6MAPT
Hydrochloric Acid SCHEMBL3364505 0.85 MEN1 (0.40) MEN1TP53CYP1A2CYP2D6MAPT
SCHEMBL29201320 0.85 MEN1 (0.40) MEN1TP53CYP1A2CYP2D6MAPT
SCHEMBL1226951 0.78 MEN1 (0.39) MEN1TP53CYP1A2CYP2D6MAPT
SCHEMBL10002121 0.78 ESR1 (0.33) MEN1TP53CYP1A2CYP2D6MAPT
Hydrochloric Acid SCHEMBL3364608 0.76 MEN1 (0.46) MEN1TP53CYP1A2CYP2D6MAPT
Hydrochloric Acid SCHEMBL210855 0.76 MEN1 (0.38) MEN1TP53CYP1A2CYP2D6MAPT
Bromide SCHEMBL918125 0.76 MEN1 (0.38) MEN1TP53CYP1A2CYP2D6MAPT
SCHEMBL12555727 0.75 NPC1 (0.36) MEN1TP53CYP1A2CYP2D6MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3920701-A1 HERBICIDAL COMPOUNDS Syngenta Crop Protection AG (CH) 2021-12-15 — — EP claimed
WO-2020161163-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2020-08-13 — — WO claimed
US-20220104493-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2022-04-07 — — US disclosed
EP-3920701-A1 HERBICIDAL COMPOUNDS Syngenta Crop Protection AG (CH) 2021-12-15 — — EP disclosed
CN-113412055-A Herbicidal compounds 先正达农作物保护股份公司 2021-09-17 — — CN disclosed
WO-2020161163-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2020-08-13 — — WO disclosed
WO-2020161163-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2020-08-13 — — WO disclosed
EP-2372446-B1 Electrochromic display apparatus and method of manufacturing the same RICOH CO LTD (JP) 2015-09-09 — — EP disclosed
US-9069222-B2 Electrochromic display element and display device RICOH COMPANY, LTD. (JP) 2015-06-30 — — US disclosed
US-20140268284-A1 ELECTROCHROMIC DISPLAY ELEMENT AND DISPLAY DEVICE RICOH COMPANY, LTD. (JP) 2014-09-18 — — US disclosed
US-8736941-B2 Electrochromic display apparatus and method of manufacturing the same RICOH COMPANY, LTD. (JP) 2014-05-27 — — US disclosed
US-8531754-B2 Electrochromic display element RICOH COMPANY, LTD. (JP) 2013-09-10 — — US disclosed
US-8531754-B2 Electrochromic display element RICOH COMPANY, LTD. (JP) 2013-09-10 — — US disclosed
US-20120050838-A1 ELECTROCHROMIC DISPLAY APPARATUS RICOH COMPANY, LTD. (JP) 2012-03-01 — — US disclosed
US-20110279884-A1 ELECTROCHROMIC DISPLAY ELEMENT RICOH COMPANY, LTD. (JP) 2011-11-17 — — US disclosed
US-20110279884-A1 ELECTROCHROMIC DISPLAY ELEMENT RICOH COMPANY, LTD. (JP) 2011-11-17 — — US disclosed
US-20110222139-A1 ELECTROCHROMIC DISPLAY APPARATUS AND METHOD OF MANUFACTURING THE SAME RICOH COMPANY, LTD., (JP) 2011-09-15 — — 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 (1 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-20220104493-A1 HERBICIDAL COMPOUNDS DDT, ACHE, GSTO1 NQO2 60/4885MEN1 3365/4885TP53 3439/4885

“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.

Send feedback