SCHEMBL21069154

SCHEMBL21069154

c1ccc(-c2ccc3c(c2)c2cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc2n3-c2ccccn2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
LMNA P02545 4/20 0.39
MAPT P10636 4/20 0.39
KDM4E B2RXH2 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
MAPK1 P28482 2/20 0.39
HTT P42858 1/20 0.39
UHRF1 Q96T88 1/20 0.39
PLAUR Q03405 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39
NOX4 Q9NPH5 1/20 0.39
NOX1 Q9Y5S8 1/20 0.39
SLC6A7 Q99884 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAT2A P31153 2/20 0.38
HPGD P15428 4/20 0.37
FFAR4 Q5NUL3 4/20 0.37
SLC11A2 P49281 2/20 0.36
TP53 P04637 2/20 0.35

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
SCHEMBL30118206 0.99 ALDH1A1 (0.40) ALDH1A1LMNAMAPTKDM4EMEN1
SCHEMBL16785745 0.90 ALDH1A1 (0.39) ALDH1A1LMNAMAPTKDM4EMEN1
SCHEMBL21069127 0.89 ALDH1A1 (0.41) ALDH1A1LMNAMAPTKDM4EMEN1
SCHEMBL17228357 0.88 KDM4E (0.38) ALDH1A1LMNAMAPTKDM4EMEN1
SCHEMBL30118232 0.87 ALDH1A1 (0.38) ALDH1A1LMNAMAPTKDM4EMEN1
SCHEMBL18058642 0.87 MAT2A (0.36) ALDH1A1LMNAMAPTKDM4EMEN1
SCHEMBL21069112 0.87 ALDH1A1 (0.38) ALDH1A1LMNAMAPTKDM4EMEN1
SCHEMBL22126418 0.87 PIK3CA (0.40) ALDH1A1LMNAMAPTKDM4EMEN1
SCHEMBL17124087 0.87 ALDH1A1 (0.40) ALDH1A1LMNAMAPTKDM4EMEN1
SCHEMBL12093306 0.87 ALDH1A1 (0.36) ALDH1A1LMNAMAPTKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11575088-B2 Composition of matter for use in organic light-emitting diodes KYULUX, INC. (JP) 2023-02-07 US disclosed
US-20190198777-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES KYULUX, INC. (JP) 2019-06-27 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 (2 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-11575088-B2 Composition of matter for use in organic light-emitting diodes CRY2, CYBA, ALDH1A2 ALDH1A1 116/4885LMNA 1209/4885MAPT 159/4885
US-20190198777-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES CRY2, CYBA, ALDH1A2 ALDH1A1 116/4885LMNA 1209/4885MAPT 159/4885

“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.