SCHEMBL21155177

SCHEMBL21155177

O=[N+]([O-])c1ccccc1-c1cc2sc3ccccc3c2c2ncc3ncccc3c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.43
▸ MAPT P10636 8/20 0.41
▸ ALDH1A1 P00352 7/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ NCOA1 Q15788 1/20 0.41
▸ NCOA3 Q9Y6Q9 1/20 0.41
▸ MEN1 O00255 7/20 0.38
▸ KMT2A Q03164 7/20 0.38
▸ KDM4E B2RXH2 5/20 0.38
▸ CTSB P07858 2/20 0.38
▸ IDO1 P14902 2/20 0.38
▸ TDO2 P48775 2/20 0.38
▸ GAA P10253 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ ERN1 O75460 1/20 0.36
▸ PDE10A Q9Y233 1/20 0.36
▸ LMNA P02545 4/20 0.36
▸ SMN1; SMN2 Q16637 4/20 0.36
▸ TDP1 Q9NUW8 4/20 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
SCHEMBL21155836 0.86 MAPT (0.47) POLBMAPTALDH1A1L3MBTL1NCOA1
SCHEMBL21155900 0.81 POLB (0.51) POLBMAPTALDH1A1L3MBTL1NCOA1
SCHEMBL21155172 0.80 KMT2A (0.43) MAPTALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL16231228 0.78 ALDH1A1 (0.44) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL21114912 0.78 TXNRD1 (0.42) MAPTALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL21155838 0.77 ALDH1A1 (0.38) MAPTALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL21155159 0.77 ALDH1A1 (0.43) POLBMAPTALDH1A1L3MBTL1NCOA1
SCHEMBL21155840 0.75 MEN1 (0.46) POLBMAPTALDH1A1L3MBTL1MEN1
SCHEMBL21155439 0.73 MAPT (0.38) POLBMAPTALDH1A1L3MBTL1MEN1
SCHEMBL21155432 0.73 POLB (0.42) POLBMAPTALDH1A1L3MBTL1NCOA1

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-3512848-B1 COMPOUNDS WITH CARBAZOLE STRUCTURES MERCK PATENT GMBH (DE) 2020-11-18 — — EP disclosed
US-20190214574-A1 COMPOUNDS WITH CARBAZOLE STRUCTURES MERCK PATENT GMBH (DE) 2019-07-11 — — 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-20190214574-A1 COMPOUNDS WITH CARBAZOLE STRUCTURES CYCS, CYP3A4, CYP2E1 POLB 1544/4885MAPT 2010/4885ALDH1A1 506/4885

“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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