SCHEMBL23855865

SCHEMBL23855865

N#Cc1ccc(-c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)ncc2-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)cc1C#N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
KDM4E B2RXH2 3/20 0.39
LMNA P02545 2/20 0.39
RXFP1 Q9HBX9 2/20 0.39
HTT P42858 1/20 0.39
THRB P10828 1/20 0.39
HPGD P15428 2/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP11B1 P15538 2/20 0.38
CYP11B2 P19099 2/20 0.38
FLT3 P36888 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
PLAUR Q03405 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL23855926 0.97 ALDH1A1 (0.38) ALDH1A1KDM4ELMNARXFP1HTT
SCHEMBL23855931 0.91 ALDH1A1 (0.35) ALDH1A1KDM4ELMNARXFP1HTT
SCHEMBL23855969 0.89 ALDH1A1 (0.32) ALDH1A1KDM4ELMNARXFP1HTT
SCHEMBL21928999 0.89 GABRG2 (0.39) ALDH1A1KDM4ELMNARXFP1HPGD
SCHEMBL23855990 0.89 CYP11B2 (0.38) ALDH1A1KDM4ELMNARXFP1HTT
SCHEMBL23869366 0.87 SMN1; SMN2 (0.41) ALDH1A1KDM4ERXFP1HPGDMAPK1
SCHEMBL20771696 0.87 GRM5 (0.41) ALDH1A1LMNAMAPK1
SCHEMBL21928541 0.86 GABRA1 (0.40) CYP11B2MAOB
SCHEMBL23855971 0.86 ALDH1A1 (0.39) ALDH1A1KDM4ELMNARXFP1HTT
SCHEMBL21929062 0.86 ALDH1A1 (0.37) ALDH1A1KDM4ELMNAHPGDMAPK1

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-12029116-B2 Composition of matter for use in organic light-emitting diodes KYULUX, INC. (JP) 2024-07-02 US disclosed
US-20210305517-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES KYULUX, INC. (JP) 2021-09-30 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-12029116-B2 Composition of matter for use in organic light-emitting diodes OPRD1, DRD1, DRD3 ALDH1A1 812/4885KDM4E 3197/4885LMNA 2653/4885
US-20210305517-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES OPRD1, DRD1, DRD3 ALDH1A1 812/4885KDM4E 3197/4885LMNA 2653/4885

“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.