SCHEMBL22891638

SCHEMBL22891638

c1ccc(Nc2ccc3c(c2)-c2ccccc2C32c3ccccc3N(c3ccc(-c4ccccc4)cc3)c3ccccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 3/20 0.40
▸ HSP90AA1 P07900 1/20 0.38
▸ GNG2 P59768 1/20 0.36
▸ GNB1 P62873 1/20 0.36
▸ PGR P06401 1/20 0.35
▸ PDE6D O43924 1/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ GFER P55789 2/20 0.35
▸ APP P05067 1/20 0.35
▸ ALDH1A1 P00352 4/20 0.33
▸ MAPT P10636 3/20 0.33
▸ AR P10275 1/20 0.33
▸ HSD17B10 Q99714 2/20 0.32
▸ TDP1 Q9NUW8 2/20 0.32
▸ CYP3A4 P08684 2/20 0.32
▸ HPGD P15428 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ GAA P10253 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
SCHEMBL22891763 0.96 GNG2 (0.40) PDK2HSP90AA1GNG2GNB1PGR
SCHEMBL22891640 0.95 PDK2 (0.40) PDK2HSP90AA1GNG2GNB1PGR
SCHEMBL22891468 0.92 PDK2 (0.43) PDK2HSP90AA1GNG2GNB1PGR
SCHEMBL23637461 0.89 PGR (0.43) PDK2HSP90AA1GNG2GNB1PGR
SCHEMBL22891764 0.87 GNG2 (0.45) PDK2HSP90AA1GNG2GNB1PGR
SCHEMBL24969755 0.86 PGR (0.38) PDK2GNG2GNB1PGRAPP
SCHEMBL14681509 0.85 PDK2 (0.47) PDK2MEN1KMT2AGFERAPP
SCHEMBL22245913 0.85 PDK2 (0.47) PDK2MEN1KMT2AGFERAPP
SCHEMBL22891464 0.85 PDK2 (0.46) PDK2HSP90AA1GNG2GNB1PGR
SCHEMBL22891467 0.85 PDK2 (0.49) PDK2HSP90AA1GNG2GNB1PGR

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-3764416-B1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO LTD (KR) 2022-01-26 — — EP disclosed
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 PDK2 2546/4885HSP90AA1 4808/4885GNG2 2366/4885

“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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