SCHEMBL26591978

SCHEMBL26591978

N#Cc1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4cc(-c5ccccc5)ccc4-c4ccccc4)n3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 14/20 0.52
ABCB1 P08183 9/20 0.52
ABCC1 P33527 4/20 0.47
GABRA1 P14867 1/20 0.47
GABRG2 P18507 1/20 0.47
GABRB3 P28472 1/20 0.47
GABRA5 P31644 1/20 0.47
GABRA3 P34903 1/20 0.47
MYC P01106 1/20 0.44
ALDH1A3 P47895 1/20 0.43
MAP4K4 O95819 1/20 0.43
CYP11B2 P19099 1/20 0.42

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
SCHEMBL31643600 0.97 ABCG2 (0.52) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL25872134 0.97 ABCG2 (0.52) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL31463137 0.97 ABCG2 (0.52) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL31463139 0.97 ABCG2 (0.52) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL31643519 0.96 ABCG2 (0.49) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL31643063 0.96 ABCG2 (0.49) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL26591991 0.96 ABCG2 (0.49) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL31642854 0.96 ABCG2 (0.49) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL27368555 0.96 ABCG2 (0.49) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL26591988 0.96 ABCG2 (0.49) ABCG2ABCB1ABCC1GABRA1GABRG2

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-20230337532-A1 TRIAZINE COMPOUND, MATERIAL FOR ORGANIC LIGHT EMITTING DIODE, ELECTRON TRANSPORT MATERIAL FOR ORGANIC LIGHT EMITTING DIODE, AND ORGANIC LIGHT EMITTING DIODE TOSOH CORPORATION (JP) 2023-10-19 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-20230337532-A1 TRIAZINE COMPOUND, MATERIAL FOR ORGANIC LIGHT EMITTING DIODE, ELECTRON TRANSPORT MATERIAL FOR ORGANIC LIGHT EMITTING DIODE, AND ORGANIC LIGHT EMITTING DIODE ARNT, TPH1, AHR ABCG2 942/4885ABCB1 552/4885ABCC1 220/4885

“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.