SCHEMBL17915598

SCHEMBL17915598

O=[N+]([O-])c1cc(-n2c3ccccc3c3ccccc32)c(-n2c3ccccc3c3ccccc32)cc1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.47
▸ TDP1 Q9NUW8 3/20 0.47
▸ CRHBP P24387 1/20 0.41
▸ CRHR2 Q13324 1/20 0.41
▸ MAPT P10636 4/20 0.39
▸ POLB P06746 2/20 0.38
▸ ATM Q13315 2/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ LMNA P02545 3/20 0.38
▸ GAA P10253 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ CYP19A1 P11511 1/20 0.38
▸ PTGES O14684 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ PKM P14618 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HPRT1 P00492 1/20 0.36

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
SCHEMBL18645528 0.83 ALDH1A1 (0.43) ALDH1A1TDP1CRHBPCRHR2MAPT
SCHEMBL25963545 0.81 ALDH1A1 (0.50) ALDH1A1TDP1CRHBPCRHR2MAPT
SCHEMBL25963736 0.79 ALDH1A1 (0.47) ALDH1A1TDP1CRHBPCRHR2MAPT
SCHEMBL15461976 0.77 ALDH1A1 (0.69) ALDH1A1TDP1CRHBPCRHR2MAPT
SCHEMBL17705007 0.76 MAPT (0.43) ALDH1A1TDP1CRHBPCRHR2MAPT
SCHEMBL16726785 0.76 ATM (0.45) ALDH1A1TDP1CRHBPCRHR2MAPT
SCHEMBL869478 0.76 TDP1 (0.50) ALDH1A1TDP1MAPTATMHSD17B10
SCHEMBL29442065 0.76 TDP1 (0.50) ALDH1A1TDP1MAPTATMHSD17B10
SCHEMBL19823572 0.75 GRIA1 (0.46) ALDH1A1TDP1MAPTPOLBLMNA
SCHEMBL22007056 0.75 ALDH1A1 (0.67) ALDH1A1TDP1CRHBPCRHR2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9963429-B2 Carbazole derivative, material for organic electroluminescent element which comprises same, and organic electroluminescent element and electronic device each manufactured using same IDEMITSU KOSAN CO., LTD. (JP) 2018-05-08 — — US disclosed
US-9963429-B2 Carbazole derivative, material for organic electroluminescent element which comprises same, and organic electroluminescent element and electronic device each manufactured using same IDEMITSU KOSAN CO., LTD. (JP) 2018-05-08 — — US disclosed
US-20160204361-A1 CARBAZOLE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT WHICH COMPRISES SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE EACH MANUFACTURED USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-07-14 — — US disclosed
US-20160204361-A1 CARBAZOLE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT WHICH COMPRISES SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE EACH MANUFACTURED USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-07-14 — — 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-20160204361-A1 CARBAZOLE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT WHICH COMPRISES SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE EACH MANUFACTURED USING SAME L1CAM, EPB41, EPX ALDH1A1 738/4885TDP1 2250/4885CRHBP 4135/4885

“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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