SCHEMBL22891763

SCHEMBL22891763

c1ccc(-c2ccc(Nc3ccc4c(c3)-c3ccccc3C43c4ccccc4N(c4ccccc4)c4ccccc43)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GNG2 P59768 2/20 0.40
▸ GNB1 P62873 2/20 0.40
▸ PGR P06401 2/20 0.38
▸ PDK2 Q15119 3/20 0.38
▸ ADAMTS5 Q9UNA0 1/20 0.34
▸ PDE6D O43924 1/20 0.33
▸ APP P05067 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ GFER P55789 1/20 0.31
▸ ALDH1A1 P00352 3/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CES2 O00748 1/20 0.31
▸ BCHE P06276 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ CES1 P23141 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ TNK2 Q07912 1/20 0.31

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
SCHEMBL22891638 0.96 PDK2 (0.40) GNG2GNB1PGRPDK2ADAMTS5
SCHEMBL22891468 0.94 PDK2 (0.43) GNG2GNB1PGRPDK2APP
SCHEMBL23637461 0.93 PGR (0.43) GNG2GNB1PGRPDK2ADAMTS5
SCHEMBL22891640 0.91 PDK2 (0.40) GNG2GNB1PGRPDK2ADAMTS5
SCHEMBL24969755 0.89 PGR (0.38) GNG2GNB1PGRPDK2APP
SCHEMBL22891764 0.88 GNG2 (0.45) GNG2GNB1PGRPDK2ADAMTS5
SCHEMBL22245913 0.87 PDK2 (0.47) PDK2APPMEN1KMT2AGFER
SCHEMBL14681509 0.87 PDK2 (0.47) PDK2APPMEN1KMT2AGFER
SCHEMBL22891464 0.86 PDK2 (0.46) GNG2GNB1PGRPDK2ADAMTS5
SCHEMBL22891467 0.86 PDK2 (0.49) GNG2GNB1PGRPDK2APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210013420-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2021-01-14 — — 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-20210013420-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME, AND ELECTRONIC DEVICE THEREOF PIEZO1, ORAI2, OR10J3 GNG2 2366/4885GNB1 2424/4885PGR 2596/4885

“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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