SCHEMBL22891669

SCHEMBL22891669

c1ccc(Nc2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2N3c2ccc3c(ccc4ccccc43)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.38
▸ PGR P06401 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ P2RX4 Q99571 1/20 0.32
▸ MAPK14 Q16539 2/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ GNG2 P59768 1/20 0.31
▸ GNB1 P62873 1/20 0.31
▸ TP53 P04637 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ CDC25B P30305 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ NSD2 O96028 1/20 0.30
▸ DUSP3 P51452 1/20 0.30
▸ PTPN5 P54829 1/20 0.30
▸ CASP7 P55210 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
SCHEMBL22891639 0.91 ALDH1A1 (0.46) PDK2PGRALDH1A1CYP3A4HPGD
SCHEMBL22891608 0.85 PDK2 (0.41) PDK2PGRALDH1A1CYP3A4HPGD
SCHEMBL22892676 0.85 PGR (0.30) PGR
SCHEMBL22891670 0.84 ALDH1A1 (0.46) PDK2PGRALDH1A1CYP3A4HPGD
SCHEMBL22891464 0.84 PDK2 (0.46) PDK2PGRALDH1A1CYP3A4HPGD
SCHEMBL22891673 0.79 PDK2 (0.39) PDK2PGRALDH1A1HPGD
SCHEMBL22891467 0.79 PDK2 (0.49) PDK2PGRALDH1A1CYP3A4HPGD
SCHEMBL23637461 0.78 PGR (0.43) PDK2PGRALDH1A1HSP90AA1GNG2
SCHEMBL22891671 0.78 PDK2 (0.38) PDK2PGRGNG2GNB1ATM
SCHEMBL22891468 0.77 PDK2 (0.43) PDK2PGRALDH1A1CYP3A4HPGD

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 2546/4885PGR 2596/4885ALDH1A1 1135/4885

“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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