SCHEMBL19320103

SCHEMBL19320103

O=[N+]([O-])c1ccccc1-c1ccc2sc3cc4c(cc3c2c1-c1ccccc1)c1ccccc1n4-c1ccccc1-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ EIF4E P06730 1/20 0.32
▸ CHEK1 O14757 1/20 0.30
▸ WEE1 P30291 1/20 0.30
▸ FBP1 P09467 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
SCHEMBL19320100 0.81 CHEK1 (0.32) ALDH1A1CHEK1WEE1
SCHEMBL17548824 0.80 KDM4E (0.38) ALDH1A1TDP1
SCHEMBL17548811 0.79 ALDH1A1 (0.37) ALDH1A1TDP1EIF4E
SCHEMBL26471211 0.76 ABCG2 (0.36) ALDH1A1TDP1EIF4E
SCHEMBL19320141 0.74 MAP3K9 (0.37) ALDH1A1TDP1CHEK1WEE1
SCHEMBL19325044 0.73 CDK4 (0.35) CHEK1WEE1
SCHEMBL26471210 0.73 EIF4E (0.34) ALDH1A1TDP1EIF4E
SCHEMBL26471212 0.72 EIF4E (0.35) ALDH1A1TDP1EIF4E
SCHEMBL27463788 0.72 CHEK1 (0.32) ALDH1A1TDP1CHEK1WEE1
SCHEMBL26471215 0.71 EIF4E (0.34) ALDH1A1TDP1EIF4E

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
US-20170256719-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRICAL ELEMENT USING COMPOUND, AND ELECTRONIC DEVICE COMPRISING SAME DUK SAN NEOLUX CO., LTD (KR) 2017-09-07 — — US disclosed
US-20170256719-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRICAL ELEMENT USING COMPOUND, AND ELECTRONIC DEVICE COMPRISING SAME DUK SAN NEOLUX CO., LTD (KR) 2017-09-07 — — 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-20170256719-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRICAL ELEMENT USING COMPOUND, AND ELECTRONIC DEVICE COMPRISING SAME ORAI2, VDAC2, PIEZO1 ALDH1A1 1187/4885TDP1 2081/4885EIF4E 771/4885

“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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