SCHEMBL20212109

SCHEMBL20212109

O=C1NC(=O)c2sc3c4c(c(Br)cc1c24)C(=O)NC3=O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.36
▸ PTP4A3 O75365 1/20 0.34
▸ PPOX P50336 1/20 0.32
▸ CHEK1 O14757 1/20 0.32
▸ WEE1 P30291 1/20 0.32

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
SCHEMBL19143852 0.83 GSK3B (0.47) GSK3BNPSR1PPOXCHEK1WEE1
SCHEMBL20212120 0.79 PPOX (0.39) GSK3BPTP4A3PPOXCHEK1WEE1
SCHEMBL19135976 0.77 NPSR1 (0.46) GSK3BNPSR1PPOXCHEK1WEE1
SCHEMBL20212140 0.73 PARP1 (0.46) GSK3BNPSR1PTP4A3PPOX
SCHEMBL13606492 0.70 GSK3B (0.38) GSK3BNPSR1PPOXCHEK1WEE1
SCHEMBL13606486 0.69 GSK3B (0.37) GSK3BNPSR1CHEK1WEE1
SCHEMBL10029726 0.68 PPOX (0.46) GSK3BNPSR1PPOX
SCHEMBL25262632 0.66 PPOX (0.52) GSK3BNPSR1PPOX
SCHEMBL11419704 0.66 CA1 (0.50) GSK3BNPSR1PPOXCHEK1WEE1
SCHEMBL3683890 0.66 GSK3B (0.50) GSK3BNPSR1PPOXCHEK1WEE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3333917-B1 ORGANIC THIN FILM TRANSISTOR, METHOD FOR MANUFACTURING ORGANIC THIN FILM TRANSISTOR, MATERIAL FOR ORGANIC THIN FILM TRANSISTORS, COMPOSITION FOR ORGANIC THIN FILM TRANSISTORS, ORGANIC SEMICONDUCTOR FILM, AND COMPOUND FUJIFILM CORP (JP) 2022-04-06 — — EP disclosed
US-20180159043-A1 ORGANIC THIN FILM TRANSISTOR, METHOD OF MANUFACTURING ORGANIC THIN FILM TRANSISTOR, ORGANIC THIN FILM TRANSISTOR MATERIAL, ORGANIC THIN FILM TRANSISTOR COMPOSITION, ORGANIC SEMICONDUCTOR FILM, AND COMPOUND FUJIFILM CORPORATION (JP) 2018-06-07 — — 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-20180159043-A1 ORGANIC THIN FILM TRANSISTOR, METHOD OF MANUFACTURING ORGANIC THIN FILM TRANSISTOR, ORGANIC THIN FILM TRANSISTOR MATERIAL, ORGANIC THIN FILM TRANSISTOR COMPOSITION, ORGANIC SEMICONDUCTOR FILM, AND COMPOUND SLCO2A1, SLCO4C1, SLCO2B1 GSK3B 1880/4885NPSR1 4367/4885PTP4A3 1169/4885

“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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