SCHEMBL113975

SCHEMBL113975

Cc1cc(C=NO)ccc1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.43
RAB9A P51151 2/20 0.43
NPFFR1 Q9GZQ6 3/20 0.41
NPFFR2 Q9Y5X5 3/20 0.41
HTT P42858 3/20 0.39
GAA P10253 3/20 0.39
MAPK1 P28482 2/20 0.38
KMT2A Q03164 2/20 0.38
ACHE P22303 1/20 0.38
POLB P06746 2/20 0.37
JAK2 O60674 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
ALOX12 P18054 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PKM P14618 1/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL111119 1.00 ALDH1A1 (0.46) ALDH1A1KDM4EL3MBTL1SMN1; SMN2RAB9A
SCHEMBL648157 1.00 ALDH1A1 (0.46) ALDH1A1KDM4EL3MBTL1SMN1; SMN2RAB9A
SCHEMBL1304437 0.86 SMN1; SMN2 (0.47) ALDH1A1KDM4EL3MBTL1SMN1; SMN2RAB9A
SCHEMBL1304439 0.86 SMN1; SMN2 (0.47) ALDH1A1KDM4EL3MBTL1SMN1; SMN2RAB9A
SCHEMBL2726909 0.86 SMN1; SMN2 (0.47) ALDH1A1KDM4EL3MBTL1SMN1; SMN2RAB9A
SCHEMBL7820864 0.82 ALDH1A1 (0.39) ALDH1A1KDM4ESMN1; SMN2RAB9ANPFFR1
SCHEMBL7820867 0.82 ALDH1A1 (0.39) ALDH1A1KDM4ESMN1; SMN2RAB9ANPFFR1
SCHEMBL1937076 0.81 ALDH1A1 (0.50) ALDH1A1KDM4EL3MBTL1SMN1; SMN2RAB9A
SCHEMBL2166114 0.81 ALDH1A1 (0.50) ALDH1A1KDM4EL3MBTL1SMN1; SMN2RAB9A
SCHEMBL1937074 0.81 ALDH1A1 (0.50) ALDH1A1KDM4EL3MBTL1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118894789-A Method for continuously synthesizing alpha-chloro oxime 苏利(宁夏)新材料科技有限公司 2024-11-05 CN disclosed
WO-2024120137-A1 SUBSTITUTED BENZAMIDE ISOXAZOLINE DERIVATIVE OR AGROCHEMICALLY ACCEPTABLE SALT THEREOF, COMPOSITION, AND USE THEREOF 海利尔药业集团股份有限公司 2024-06-13 WO disclosed
CN-117777045-A Substituted benzamide isoxazoline derivative or salt, composition and application thereof as pesticide acceptable 青岛蓝晶雨生物科技有限公司 2024-03-29 CN disclosed
CN-116396235-B Synthetic method of isoxazoline insecticide and intermediate thereof 宁波大学科学技术学院 2024-01-05 CN disclosed
CN-112552252-B Preparation method of fluororalrana intermediate 浙江美诺华药物化学有限公司 2024-01-02 CN disclosed
CN-115785017-B Substituted benzamide isoxazoline derivative or salt, composition and application thereof as pesticide acceptable 海利尔药业集团股份有限公司 2023-12-08 CN disclosed
US-20230355590-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE NISSAN CHEMICAL CORPORATION (JP) 2023-11-09 US disclosed
CN-113563322-B Substituted benzamide isoxazoline derivative or salt acceptable as pesticide, composition and application thereof 海利尔药业集团股份有限公司 2023-07-07 CN disclosed
CN-116396235-A Synthetic method of isoxazoline insecticide and intermediate thereof 宁波大学科学技术学院 2023-07-07 CN disclosed
CN-113582987-B Substituted benzamide isoxazoline derivative or salt acceptable as pesticide, composition and application thereof 海利尔药业集团股份有限公司 2023-06-30 CN disclosed
US-20090312330-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-12-17 US disclosed
WO-2009080250-A2 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2009-07-02 WO disclosed
WO-2009049846-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2009-04-23 WO disclosed
EP-1932836-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND HARMFUL ORGANISM-CONTROLLING AGENT Nissan Chemical Industries, Ltd. (JP) 2008-06-18 EP disclosed
US-20070066617-A1 Insecticidal and acaricidal activity for many agricultural insect pests, spider mites; endo- or ecto-parasiticide for mammals or birds; veterinary medicine; environmentally friendly NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-03-22 US disclosed
EP-0799226-B1 TETRACYCLIC SPIRO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS 5HT1D RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 2001-02-07 EP disclosed
US-5972951-A Tetracyclic spiro compounds, process for their preparation and their use as 5HT1D receptor antagonists SMITHKLINE BEECHAM PLC (GB) 1999-10-26 US disclosed
CN-1175256-A tetracyclic spiro compounds, process for their preparation and their use as 5HT1D receptor antagonists SMITHKLINE BEECHAM PLC (GB) 1998-03-04 CN disclosed
EP-0799226-A1 TETRACYCLIC SPIRO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS 5HT1D RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1997-10-08 EP disclosed
WO-1996019477-A1 TETRACYCLIC SPIRO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS 5HT1D RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1996-06-27 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 (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-20230355590-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE HDAC7, ACHE, BRDT ALDH1A1 865/4885KDM4E 1334/4885L3MBTL1 2698/4885
US-20090312330-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE ATM, CHRM1, NAT1 ALDH1A1 806/4885KDM4E 3394/4885L3MBTL1 818/4885
US-20070066617-A1 Insecticidal and acaricidal activity for many agricultural insect pests, spider mites; endo- or ecto-parasiticide for mammals or birds; veterinary medicine; environmentally friendly CHRM1, DDT, ATM ALDH1A1 1359/4885KDM4E 3630/4885L3MBTL1 200/4885

“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.