SCHEMBL13896338

SCHEMBL13896338

C=C1NCc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.56
CA9 Q16790 1/20 0.56
TYRO3 Q06418 1/20 0.40
NTRK2 Q16620 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
DYRK1B Q9Y463 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PARP1 P09874 2/20 0.38
PDPK1 O15530 1/20 0.38
PARP10 Q53GL7 1/20 0.38
PARP11 Q9NR21 1/20 0.38
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
METAP2 P50579 1/20 0.35
CES1 P23141 1/20 0.34
MAOA P21397 1/20 0.34
HTR5A P47898 2/20 0.34
AURKA O14965 2/20 0.34
KDR P35968 2/20 0.34

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
Iodide SCHEMBL7869094 0.98 CA12 (0.54) CA12CA9TYRO3NTRK2CLK4
SCHEMBL26378734 0.86 CA12 (0.52) CA12CA9TYRO3NTRK2CLK4
SCHEMBL1159918 0.77 PARP10 (0.59) CA12CA9PARP1PDPK1PARP10
Formaldehyde SCHEMBL28180623 0.73 CA12 (0.91) CA12CA9TYRO3NTRK2CLK4
SCHEMBL162748 0.71 CA12 (0.56) CA12CA9TYRO3NTRK2CLK4
SCHEMBL14896 0.71 CA12 (1.00) CA12CA9TYRO3NTRK2CLK4
SCHEMBL29355184 0.71 CA12 (1.00) CA12CA9TYRO3NTRK2CLK4
SCHEMBL3371709 0.71 CA12 (0.56) CA12CA9TYRO3NTRK2CLK4
SCHEMBL14581370 0.71 CA12 (0.68) CA12CA9TYRO3NTRK2CLK4
SCHEMBL4818277 0.71 CA12 (1.00) CA12CA9TYRO3NTRK2CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116283716-B Application of Cu/ETS-10 catalyst in catalytic synthesis of 3-methylene isoindoline-1-one and derivatives thereof 常州大学 2025-02-25 CN disclosed
CN-116283716-B Application of Cu/ETS-10 catalyst in catalytic synthesis of 3-methylene isoindoline-1-one and derivatives thereof 常州大学 2025-02-25 CN disclosed
US-11771086-B2 Pest control composition including novel iminopyridine derivative MMAG CO., LTD. (JP) 2023-10-03 US disclosed
US-11771086-B2 Pest control composition including novel iminopyridine derivative MMAG CO., LTD. (JP) 2023-10-03 US disclosed
CN-116283716-A Application of Cu/ETS-10 catalyst in catalytic synthesis of 3-methylene isoindoline-1-one and derivatives thereof 常州大学 2023-06-23 CN disclosed
CN-114907253-B Preparation method of polysubstituted 3-methylene isoindoline-1-ketone 中国科学院化学研究所 2023-04-07 CN disclosed
CN-114907253-A Preparation method of polysubstituted 3-methylene isoindoline-1-ketone 中国科学院化学研究所 2022-08-16 CN disclosed
WO-2021214472-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS NRF2 ACTIVATORS C4X DISCOVERY LIMITED (GB) 2021-10-28 WO disclosed
US-20200315172-A1 PEST CONTROL COMPOSITION INCLUDING NOVEL IMINOPYRIDINE DERIVATIVE MEIJI SEIKA PHARMA CO., LTD. (JP) 2020-10-08 US disclosed
EP-3423436-B1 PYRIDINYLMETHYL CARBAMIMIDOYLCARBAMATE DERIVATIVES AND THEIR USE AS AOC3 INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2020-09-16 EP disclosed
US-9066517-B2 Pest control agents for honeybee parasitic pests, and pest control method for honeybee parasitic pests using the pest control agents MEIJI SEIKA PHARMA CO., LTD. (JP) 2015-06-30 US disclosed
US-9066517-B2 Pest control agents for honeybee parasitic pests, and pest control method for honeybee parasitic pests using the pest control agents MEIJI SEIKA PHARMA CO., LTD. (JP) 2015-06-30 US disclosed
US-20150057288-A1 PEST CONTROL AGENTS FOR HONEYBEE PARASITIC PESTS, AND PEST CONTROL METHOD FOR HONEYBEE PARASITIC PESTS USING THE PEST CONTROL AGENTS MEIJI SEIKA PHARMA CO., LTD. (JP) 2015-02-26 US disclosed
US-20150057288-A1 PEST CONTROL AGENTS FOR HONEYBEE PARASITIC PESTS, AND PEST CONTROL METHOD FOR HONEYBEE PARASITIC PESTS USING THE PEST CONTROL AGENTS MEIJI SEIKA PHARMA CO., LTD. (JP) 2015-02-26 US disclosed
US-20150005347-A1 NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE HAVING 2-IMINO GROUP AND PEST CONTROL AGENT INCLUDING THE SAME MEIJI SEIKA PHARMA CO., LTD. (JP) 2015-01-01 US disclosed
US-20150005347-A1 NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE HAVING 2-IMINO GROUP AND PEST CONTROL AGENT INCLUDING THE SAME MEIJI SEIKA PHARMA CO., LTD. (JP) 2015-01-01 US disclosed
US-20140315839-A1 PEST CONTROL COMPOSITION INCLUDING NOVEL IMINOPYRIDINE DERIVATIVE MEIJI SEIKA PHARMA CO., LTD. (JP) 2014-10-23 US disclosed
US-20140315839-A1 PEST CONTROL COMPOSITION INCLUDING NOVEL IMINOPYRIDINE DERIVATIVE MEIJI SEIKA PHARMA CO., LTD. (JP) 2014-10-23 US disclosed
EP-2524961-A1 Fabric cleaning composition comprising hueing agent The Procter & Gamble Company (US) 2012-11-21 EP disclosed
EP-1902717-A2 Vasopressin antagonist and oxytocin antagonist Otsuka Pharmaceutical Company, Limited (JP) 2008-03-26 EP 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 (5 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-20140315839-A1 PEST CONTROL COMPOSITION INCLUDING NOVEL IMINOPYRIDINE DERIVATIVE API5, DDT, INTS9 CA12 4690/4885CA9 3730/4885TYRO3 4279/4885
US-20200315172-A1 PEST CONTROL COMPOSITION INCLUDING NOVEL IMINOPYRIDINE DERIVATIVE API5, DDT, INTS9 CA12 4690/4885CA9 3730/4885TYRO3 4279/4885
US-11771086-B2 Pest control composition including novel iminopyridine derivative API5, DDT, INTS9 CA12 4690/4885CA9 3730/4885TYRO3 4279/4885
US-20150005347-A1 NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE HAVING 2-IMINO GROUP AND PEST CONTROL AGENT INCLUDING THE SAME CBR1, CBR3, NIT2 CA12 3933/4885CA9 2162/4885TYRO3 2831/4885
US-20150057288-A1 PEST CONTROL AGENTS FOR HONEYBEE PARASITIC PESTS, AND PEST CONTROL METHOD FOR HONEYBEE PARASITIC PESTS USING THE PEST CONTROL AGENTS API5, CTRL, STOM CA12 693/4885CA9 258/4885TYRO3 4731/4885

“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.