SCHEMBL18328348

SCHEMBL18328348

Brc1cc(Br)cc(-c2cc3c(c4ccccc24)CC3)c1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA4 P22748 1/20 0.33
▸ CA6 P23280 1/20 0.33
▸ CCNB2 O95067 1/20 0.33
▸ CDK1 P06493 1/20 0.33
▸ CCNB1 P14635 1/20 0.33
▸ CCNB3 Q8WWL7 1/20 0.33
▸ BCHE P06276 1/20 0.30
▸ ACHE P22303 1/20 0.30
▸ CHRNB4 P30926 1/20 0.30
▸ CHRNA3 P32297 1/20 0.30

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
SCHEMBL30849134 1.00 TDP1 (0.34) TDP1L3MBTL1CA1CA2CA4
SCHEMBL26145166 0.86 CHRNB4 (0.38) TDP1L3MBTL1CA1CA2CA4
SCHEMBL30541551 0.76 ALDH1A1 (0.34) TDP1L3MBTL1CA1CA2CA4
SCHEMBL18328353 0.76 ALDH1A1 (0.34) TDP1L3MBTL1CA1CA2CA4
SCHEMBL18328343 0.75 PNMT (0.40) TDP1L3MBTL1CA1CA2CA4
SCHEMBL18328346 0.72 MAOA (0.46) —
SCHEMBL21370518 0.70 MAOA (0.47) CA1CA2
SCHEMBL17915432 0.69 ALDH1A1 (0.33) L3MBTL1
SCHEMBL26568300 0.67 — —
SCHEMBL22294679 0.67 ESR1 (0.31) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023157864-A1 ORGANIC SEMICONDUCTOR INK, ORGANIC FILM, PHOTOELECTRIC CONVERSION LAYER, METHOD FOR PRODUCING PHOTOELECTRIC CONVERSION LAYER, AND ORGANIC PHOTOELECTRIC CONVERSION ELEMENT 三菱ケミカル株式会社 2023-08-24 — — WO disclosed
WO-2023112943-A1 ORGANIC SEMICONDUCTOR INK, PHOTOELECTRIC CONVERSION LAYER, AND ORGANIC PHOTOELECTRIC CONVERSION ELEMENT 三菱ケミカル株式会社 2023-06-22 — — WO disclosed
EP-3115395-B1 POLYMER, COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC EL DISPLAY DEVICE, AND ORGANIC EL LIGHTING DEVICE MITSUBISHI CHEM CORP (JP) 2020-08-05 — — EP disclosed
EP-3115395-A1 POLYMER, COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC EL DISPLAY DEVICE, AND ORGANIC EL LIGHTING DEVICE Mitsubishi Chemical Corporation (JP) 2017-01-11 — — EP disclosed
US-20160372676-A1 POLYMER, COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC EL DISPLAY DEVICE, AND ORGANIC EL LIGHTING DEVICE MITSUBISHI CHEMICAL CORPORATION (JP) 2016-12-22 — — US disclosed
US-20160372676-A1 POLYMER, COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC EL DISPLAY DEVICE, AND ORGANIC EL LIGHTING DEVICE MITSUBISHI CHEMICAL CORPORATION (JP) 2016-12-22 — — 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-20160372676-A1 POLYMER, COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC EL DISPLAY DEVICE, AND ORGANIC EL LIGHTING DEVICE ELMO1, ELAVL1, ELAVL3 TDP1 2372/4885L3MBTL1 740/4885CA1 4588/4885

“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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