SCHEMBL23948404

SCHEMBL23948404

c1ccc(-n2c3ccccc3c3c2ccc2c4c5c(ccc4n(-c4ccccc4)c23)c2cnccc2n2c3cnccc3nc52)cc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MAOA P21397 4/20 0.31
MAOB P27338 4/20 0.31
ACHE P22303 1/20 0.31
TOP2A P11388 1/20 0.31
RPS6KA5 O75582 1/20 0.30
PDE2A O00408 1/20 0.30
PDE4D Q08499 1/20 0.30
PDE11A Q9HCR9 1/20 0.30
PDE10A Q9Y233 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
SCHEMBL23949030 0.93 KDM4E (0.36) AOC3KDM4EATML3MBTL1ALDH1A1
SCHEMBL23948398 0.89 KDM4E (0.36) AOC3KDM4EATML3MBTL1ALDH1A1
SCHEMBL23948330 0.88 ATM (0.35) KDM4EATML3MBTL1ALDH1A1RPS6KA5
SCHEMBL23948403 0.87 ADORA3 (0.35) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL23948633 0.86 KDM4E (0.35) AOC3KDM4EATML3MBTL1ALDH1A1
SCHEMBL23948755 0.82 RPS6KA5 (0.32) KDM4EATML3MBTL1ALDH1A1RPS6KA5
SCHEMBL23948262 0.80 KDM4E (0.37) AOC3KDM4EATML3MBTL1ALDH1A1
SCHEMBL21890204 0.80 KDM4E (0.47) KDM4EATML3MBTL1ALDH1A1
SCHEMBL26329938 0.80 KDM4E (0.47) KDM4EATML3MBTL1ALDH1A1MAOA
SCHEMBL26329939 0.80 KDM4E (0.47) KDM4EATML3MBTL1ALDH1A1MAOA

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-20210323963-A1 Functional Materials Based on Stable Chemical Structure ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY 2021-10-21 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-20210323963-A1 Functional Materials Based on Stable Chemical Structure TEAD4, TEAD2, TEAD1 AOC3 490/4885KDM4E 2817/4885ATM 2872/4885

“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.