SCHEMBL22751024

SCHEMBL22751024

N#Cc1ccc2cc(-n3c4ccccc4c4cccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c43)c3ccccc3c2c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 8/20 0.37
ATM Q13315 2/20 0.36
KDM4E B2RXH2 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PDPK1 O15530 1/20 0.36
IRAK4 Q9NWZ3 2/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAT2A P31153 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HSD17B10 Q99714 1/20 0.32
G6PD P11413 2/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31

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
SCHEMBL22751009 0.97 TDP2 (0.36) TDP2ATMKDM4EL3MBTL1PDPK1
SCHEMBL22751107 0.94 TDP2 (0.37) TDP2ATMKDM4EL3MBTL1PDPK1
SCHEMBL22751039 0.91 TDP2 (0.36) TDP2ATMKDM4EL3MBTL1PDPK1
SCHEMBL22751042 0.90 KDM4E (0.35) TDP2ATMKDM4EL3MBTL1PDPK1
SCHEMBL22751011 0.90 KDM4E (0.35) TDP2ATMKDM4EL3MBTL1PDPK1
SCHEMBL22751076 0.90 ATM (0.41) TDP2ATMKDM4EL3MBTL1PDPK1
SCHEMBL22751091 0.90 TDP2 (0.40) TDP2ATMKDM4EL3MBTL1G6PD
SCHEMBL22751034 0.89 PDPK1 (0.41) TDP2ATMKDM4EL3MBTL1PDPK1
SCHEMBL22751008 0.89 PDPK1 (0.41) TDP2ATMKDM4EL3MBTL1PDPK1
SCHEMBL22751022 0.89 PDPK1 (0.38) TDP2ATMKDM4EL3MBTL1PDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10862049-B2 Composition, organic-electroluminescence-device material, composition film, organic electroluminescence device, and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2020-12-08 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-10862049-B2 Composition, organic-electroluminescence-device material, composition film, organic electroluminescence device, and electronic device PIEZO1, C1S, C5 TDP2 1324/4885ATM 2426/4885KDM4E 2863/4885

“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.