SCHEMBL23855846

SCHEMBL23855846

CC(C)(C)c1ccc2c(c1)c1ccccc1n2-c1cc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)c(-n2c3ccccc3c3cc(C(C)(C)C)ccc32)c(-n2c3ccccc3c3cc(C(C)(C)C)ccc32)n1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.36
ABCG2 Q9UNQ0 2/20 0.35
MEN1 O00255 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
GBA1 P04062 1/20 0.32
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL31037697 1.00 TP53 (0.36) TP53ABCG2MEN1RAB9AKMT2A
SCHEMBL23855892 0.91 ABCG2 (0.33) TP53ABCG2MEN1RAB9AKMT2A
SCHEMBL31037710 0.91 ABCG2 (0.33) TP53ABCG2MEN1RAB9AKMT2A
SCHEMBL31037685 0.88 MAPT (0.33) TP53ABCG2MEN1RAB9AKMT2A
SCHEMBL23855833 0.88 MAPT (0.33) TP53ABCG2MEN1RAB9AKMT2A
SCHEMBL23855907 0.87 ABCG2 (0.35) TP53ABCG2MEN1RAB9AKMT2A
SCHEMBL23855959 0.86 TP53 (0.40) TP53ABCG2MEN1RAB9AKMT2A
SCHEMBL31037673 0.85 L3MBTL1 (0.33) TP53MEN1RAB9AKMT2AALDH1A1
SCHEMBL23855910 0.85 L3MBTL1 (0.33) TP53MEN1RAB9AKMT2AALDH1A1
SCHEMBL23855975 0.83 ABCG2 (0.35) TP53ABCG2MEN1RAB9AKMT2A

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 TP53 4378/4885ABCG2 2195/4885MEN1 3613/4885
US-20210305517-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES OPRD1, DRD1, DRD3 TP53 4378/4885ABCG2 2195/4885MEN1 3613/4885

“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.