SCHEMBL29995754

SCHEMBL29995754

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccncc4)c(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.41
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MAPT P10636 6/20 0.37
▸ KMT2A Q03164 4/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ TSHR P16473 3/20 0.37
▸ USP2 O75604 2/20 0.37
▸ HSP90AA1 P07900 1/20 0.37
▸ PTGER4 P35408 1/20 0.37
▸ PIK3CA P42336 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ DYRK1A Q13627 1/20 0.36
▸ S1PR1 P21453 1/20 0.35
▸ S1PR3 Q99500 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ HTT P42858 2/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MAPK14 Q16539 2/20 0.34
▸ HPGD P15428 1/20 0.34

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
SCHEMBL20596500 0.92 KDM4E (0.49) KDM4EATML3MBTL1MAPTKMT2A
SCHEMBL16943259 0.91 KDM4E (0.45) KDM4EATML3MBTL1MAPTKMT2A
SCHEMBL29996402 0.89 CYP11B1 (0.40) KDM4EATML3MBTL1MAPTKMT2A
SCHEMBL29996233 0.89 KDM4E (0.41) KDM4EATML3MBTL1MAPTKMT2A
SCHEMBL17483421 0.88 KDM4E (0.47) KDM4EATML3MBTL1MAPTKMT2A
SCHEMBL17483419 0.88 KDM4E (0.47) KDM4EATML3MBTL1MAPTKMT2A
SCHEMBL20937550 0.87 MAPT (0.38) KDM4EATML3MBTL1MAPTKMT2A
SCHEMBL29997093 0.87 KMT2A (0.44) KDM4EATML3MBTL1MAPTKMT2A
SCHEMBL17483410 0.87 KDM4E (0.49) KDM4EATML3MBTL1MAPTKMT2A
SCHEMBL17483350 0.87 KDM4E (0.45) KDM4EATML3MBTL1MAPTKMT2A

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-11498914-B2 Composition of matter for use in organic light-emitting diodes KYULUX, INC. (JP) 2022-11-15 — — 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-11498914-B2 Composition of matter for use in organic light-emitting diodes CRY2, SLCO1B3, NDUFV3 KDM4E 4364/4885ATM 1817/4885L3MBTL1 1198/4885

“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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