SCHEMBL22751065

SCHEMBL22751065

c1ccc(-c2nc(-c3ccccc3-c3ccccc3)nc(-n3c4ccccc4c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc43)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ ATM Q13315 2/20 0.41
▸ PTGER4 P35408 2/20 0.37
▸ ABCG2 Q9UNQ0 3/20 0.33
▸ NPY5R Q15761 1/20 0.32
▸ AVPR1A P37288 1/20 0.32
▸ TSPO P30536 1/20 0.32
▸ KMT2A Q03164 4/20 0.32
▸ IL1R1 P14778 1/20 0.32
▸ MEN1 O00255 3/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ HTT P42858 2/20 0.31
▸ POLB P06746 1/20 0.31
▸ CTDSP1 Q9GZU7 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ ADORA2A P29274 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
SCHEMBL16726733 0.96 KDM4E (0.44) KDM4EL3MBTL1ATMPTGER4ABCG2
SCHEMBL19845169 0.95 KDM4E (0.43) KDM4EL3MBTL1ATMPTGER4ABCG2
SCHEMBL19845187 0.95 KDM4E (0.43) KDM4EL3MBTL1ATMPTGER4ABCG2
SCHEMBL19845272 0.95 KDM4E (0.43) KDM4EL3MBTL1ATMPTGER4ABCG2
SCHEMBL19845523 0.95 KDM4E (0.43) KDM4EL3MBTL1ATMPTGER4ABCG2
SCHEMBL19845487 0.95 KDM4E (0.38) KDM4EL3MBTL1ATMPTGER4ABCG2
SCHEMBL6375247 0.93 L3MBTL1 (0.47) KDM4EL3MBTL1ATMPTGER4ABCG2
SCHEMBL6373563 0.93 L3MBTL1 (0.47) KDM4EL3MBTL1ATMPTGER4ABCG2
SCHEMBL22672217 0.92 KDM4E (0.40) KDM4EL3MBTL1ATMPTGER4ABCG2
SCHEMBL21795228 0.92 KDM4E (0.44) KDM4EL3MBTL1ATMPTGER4ABCG2

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 KDM4E 2863/4885L3MBTL1 1168/4885ATM 2426/4885

“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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