SCHEMBL26122391

SCHEMBL26122391

CC(C)N1CCc2cc(CBr)ccc2C1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 5/20 0.44
▸ MOGAT2 Q3SYC2 1/20 0.39
▸ ASIC3 Q9UHC3 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ TMEM97 Q5BJF2 1/20 0.38
▸ SIGMAR1 Q99720 1/20 0.38
▸ TLR7 Q9NYK1 1/20 0.37
▸ ACACB O00763 3/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ OGA O60502 1/20 0.35
▸ HSP90AA1 P07900 1/20 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
SCHEMBL21140748 0.86 HRH3 (0.45) HRH3MOGAT2ASIC3KCNH2TMEM97
SCHEMBL21482067 0.84 HRH3 (0.44) HRH3MOGAT2ASIC3KCNH2TMEM97
SCHEMBL28641279 0.84 HRH3 (0.44) HRH3MOGAT2ASIC3KCNH2TMEM97
SCHEMBL23032967 0.84 HRH3 (0.44) HRH3MOGAT2ASIC3KCNH2TMEM97
SCHEMBL25091108 0.83 MOGAT2 (0.43) HRH3MOGAT2ASIC3KCNH2TMEM97
SCHEMBL26418968 0.79 HRH3 (0.49) HRH3MOGAT2ASIC3KCNH2TMEM97
SCHEMBL21361596 0.79 CARM1 (0.48) HRH3ASIC3ACACB
SCHEMBL26167807 0.79 HRH3 (0.40) HRH3MOGAT2KCNH2TLR7ACACB
SCHEMBL22410358 0.79 HRH3 (0.48) HRH3MOGAT2ASIC3KCNH2TMEM97
SCHEMBL21462204 0.78 HRH3 (0.48) HRH3MOGAT2ASIC3KCNH2TMEM97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250195524-A1 PYRIMIDO-PYRIDAZINONE COMPOUND AS TOLL-LIKE RECEPTOR AGONIST SHANGHAI VISONPHARMA CO., LTD. (CN) 2025-06-19 — — US disclosed
EP-4497752-A1 PYRIMIDO-PYRIDAZINONE COMPOUND AS TOLL-LIKE RECEPTOR AGONIST Shanghai Visonpharma Co., Ltd. (CN) 2025-01-29 — — EP disclosed
WO-2023179567-A1 PYRIMIDO-PYRIDAZINONE COMPOUND AS TOLL-LIKE RECEPTOR AGONIST 上海维申医药有限公司 2023-09-28 — — WO disclosed
CN-116789671-A Pyrimidopyridazinones as Toll-like receptor agonists 上海维申医药有限公司 2023-09-22 — — CN 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-20250195524-A1 PYRIMIDO-PYRIDAZINONE COMPOUND AS TOLL-LIKE RECEPTOR AGONIST TLR8, TLR7, TLR1 HRH3 966/4885MOGAT2 4258/4885ASIC3 2444/4885

“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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