SCHEMBL547649

SCHEMBL547649

O=C(O)c1ncccc1Oc1ncccn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.53
ALDH1A1 P00352 5/20 0.53
MAPT P10636 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
ALOX15 P16050 2/20 0.53
CYP3A4 P08684 1/20 0.53
TSHR P16473 1/20 0.53
BLM P54132 1/20 0.53
AGER Q15109 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
CYP1A2 P05177 1/20 0.47
MYC P01106 1/20 0.44
TDP1 Q9NUW8 1/20 0.41
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
NAPRT Q6XQN6 3/20 0.39
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
P4HTM Q9NXG6 1/20 0.38
GAA P10253 2/20 0.38

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
SCHEMBL9692034 0.90 KDM4E (0.47) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL9384848 0.84 KDM4E (0.45) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL7052917 0.84 ALDH1A1 (0.52) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL4425717 0.81 KDM4E (0.57) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL7814676 0.80 CTSA (0.57) ALDH1A1CYP3A4NPSR1CYP1A2SMN1; SMN2
SCHEMBL2424045 0.80 KMT2A (0.48) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL10707154 0.80 CXCL8 (0.50) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL7841693 0.79 CA12 (0.52) ALDH1A1KMT2AMEN1
SCHEMBL287024 0.79 KDM4E (0.55) KDM4EALDH1A1MAPTL3MBTL1ALOX15
SCHEMBL9692224 0.79 CTSA (0.56) ALDH1A1CYP3A4NPSR1CYP1A2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4735460-A2 ASCAROSIDES AND HERBICIDAL COMBINATIONS AND METHODS FOR USE Ascribe Bioscience Inc. (US) 2026-05-06 EP claimed
WO-2025006909-A2 ASCAROSIDES AND HERBICIDAL COMBINATIONS AND METHODS FOR USE Ascribe Bioscience Inc. (US) 2025-01-02 WO claimed
EP-3764788-B1 AGROCHEMICAL OIL DISPERSIONS LAMBERTI SPA (IT) 2024-11-13 EP claimed
US-11259525-B2 Stable herbicidal compositions UPL LIMITED (IN) 2022-03-01 US claimed
EP-3764788-A1 AGROCHEMICAL OIL DISPERSIONS Lamberti SPA (IT) 2021-01-20 EP claimed
US-20200404904-A1 AGROCHEMICAL OIL DISPERSIONS LAMBERTI SPA (IT) 2020-12-31 US claimed
CN-111836541-A Agrochemical oil dispersions 蓝宝迪有限公司 2020-10-27 CN claimed
WO-2019175118-A1 AGROCHEMICAL OIL DISPERSIONS LAMBERTI SPA (IT) 2019-09-19 WO claimed
US-20190261631-A1 STABLE HERBICIDAL COMPOSITIONS UPL LIMITED (IN) 2019-08-29 US claimed
WO-2018078478-A1 STABLE HERBICIDAL COMPOSITIONS UPL LIMITED (IN) 2018-05-03 WO claimed
WO-2012080208-A1 AGROCHEMICAL OIL DISPERSION LAMBERTI SPA (IT) 2012-06-21 WO claimed
EP-0582198-B1 Substituted (hetero-)aryle compounds, process for their preparation, those containing compositions and their use as safeners BAYER CROPSCIENCE GMBH (DE) 2006-02-08 EP claimed
US-20040110637-A1 Method of safening crops using isoxazoline carboxylates BAYER CROPSCIENCE GMBH (DE) 2004-06-10 US claimed
US-6667276-B1 Microemulsions of glufosinate and oxyfluorfen or glyphosate and oxyfluorfen herbicides; cosurfactants and one or more acidic phosphoric ester surfactants HOECHST SCHERING AGREVO GMBH (DE) 2003-12-23 US claimed
EP-1365648-A1 METHOD OF SAFENING CROPS USING ISOXAZOLINE CARBOXYLATES Bayer CropScience GmbH (DE) 2003-12-03 EP claimed
EP-1019368-B1 ACYLSULFAMOYL BENZOIC ACID AMIDES, PLANT PROTECTION AGENTS CONTAINING SAID ACYLSULFAMOYL BENZOIC ACID AMIDES, AND METHOD FOR PRODUCING THE SAME BAYER CROPSCIENCE GMBH (DE) 2003-03-05 EP claimed
WO-2002060256-A1 METHOD OF SAFENING CROPS USING ISOXAZOLINE CARBOXYLATES BAYER CROPSCIENCE GMBH (DE) 2002-08-08 WO claimed
US-6251827-B1 MIXTURE OF PLANT SAFENING AGENT AND ONE OR MORE PESTICIDES HOECHST SCHERING AGREVO GMBH (DE) 2001-06-26 US claimed
US-5756422-A PLANT SAFENING AGENTS HOECHST SCHERING AGREVO GMBH (DE) 1998-05-26 US claimed
US-5739079-A CEREAL, RICE, CORN CROP SAFENER MIXED WITH WEED HERBICIDE HOECHST AKTIENGESELLSCHAFT (DE) 1998-04-14 US claimed

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

For each of this compound's patents that has machine-readable text (2 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-20200404904-A1 AGROCHEMICAL OIL DISPERSIONS FASN, ASNS, ABHD6 KDM4E 1554/4885ALDH1A1 779/4885MAPT 1848/4885
US-20040110637-A1 Method of safening crops using isoxazoline carboxylates CYP2W1, CYP4Z1, CYP4X1 KDM4E 3471/4885ALDH1A1 168/4885MAPT 4649/4885

“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.