SCHEMBL12792019

SCHEMBL12792019

O=P(c1ccccc1)(c1ccccc1)n1c2ccccc2c2ccc3c4ccccc4n(-c4ncccn4)c3c21

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 2/20 0.34
▸ MCL1 Q07820 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ DUSP3 P51452 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.31
▸ DPP4 P27487 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
SCHEMBL12792062 0.84 NPSR1 (0.40) NPSR1KDM4EATML3MBTL1ALDH1A1
SCHEMBL12792112 0.83 KDM4E (0.49) NPSR1KDM4EATML3MBTL1ALDH1A1
SCHEMBL12792066 0.82 L3MBTL1 (0.32) NPSR1KDM4EL3MBTL1ALDH1A1
SCHEMBL10027554 0.81 KDM4E (0.43) MCL1KDM4EATML3MBTL1DUSP3
SCHEMBL10027553 0.77 KDM4E (0.55) MCL1KDM4EATML3MBTL1ALDH1A1
SCHEMBL12792024 0.76 NPSR1 (0.37) NPSR1KDM4EATML3MBTL1DUSP3
SCHEMBL16674345 0.75 KDM4E (0.38) MCL1KDM4EATML3MBTL1DUSP3
SCHEMBL23431347 0.74 NPSR1 (0.44) NPSR1KDM4EATML3MBTL1ALDH1A1
SCHEMBL10027562 0.74 DUSP3 (0.38) MCL1KDM4EATML3MBTL1DUSP3
SCHEMBL12792053 0.74 KDM4E (0.47) NPSR1KDM4EATML3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2293357-B1 COMPOUND FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE NIPPON STEEL & SUMIKIN CHEM CO (JP) 2014-12-10 — — EP disclosed
US-20110057184-A1 COMPOUND FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE NIPPON STEEL CHEMICAL CO., LTD. (JP) 2011-03-10 — — US disclosed
US-20110057184-A1 COMPOUND FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE NIPPON STEEL CHEMICAL CO., LTD. (JP) 2011-03-10 — — 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-20110057184-A1 COMPOUND FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE LAS1L, EML4, OXA1L NPSR1 4771/4885MCL1 3639/4885KDM4E 2598/4885

“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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