SCHEMBL17012300

SCHEMBL17012300

N#Cc1ccccc1-c1cccc(N(c2ccccc2)c2cccc(-c3ccc4c5c(cccc35)-c3c-4c(-c4ccccc4)c4ccccc4c3-c3ccccc3)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABRG2 P18507 5/20 0.36
▸ GABRB3 P28472 5/20 0.36
▸ GABRA5 P31644 3/20 0.36
▸ GABRA3 P34903 3/20 0.36
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ SLC6A2 P23975 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ TRPA1 O75762 1/20 0.35
▸ MCL1 Q07820 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ CYP1A2 P05177 2/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ ESR2 Q92731 1/20 0.34
▸ FASN P49327 2/20 0.34
▸ ALOX5AP P20292 1/20 0.34
▸ FEN1 P39748 1/20 0.34

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
SCHEMBL17132474 0.97 ESR2 (0.37) GABRG2GABRB3GABRA5GABRA3MAOA
SCHEMBL16484679 0.97 ESR2 (0.37) GABRG2GABRB3GABRA5GABRA3MAOA
SCHEMBL17132479 0.97 GABRG2 (0.34) GABRG2GABRB3GABRA5GABRA3MAOA
SCHEMBL20016802 0.93 SLC6A2 (0.34) GABRG2GABRB3GABRA5GABRA3MAOA
SCHEMBL17132468 0.92 ESR2 (0.40) GABRG2GABRB3GABRA5GABRA3MAOA
SCHEMBL16484440 0.91 ESR2 (0.36) GABRG2GABRB3GABRA5GABRA3MAOA
SCHEMBL23764345 0.91 AR (0.35) GABRG2GABRB3GABRA5GABRA3MAOA
SCHEMBL16484664 0.91 MCL1 (0.33) GABRG2GABRB3GABRA5GABRA3MAOA
SCHEMBL16485039 0.90 GABRG2 (0.39) GABRG2GABRB3GABRA5GABRA3MAOA
SCHEMBL17132481 0.90 MCL1 (0.34) GABRG2GABRB3GABRA5GABRA3MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2907803-B1 FLUORANTHENE DERIVATIVE, LUMINESCENT ELEMENT MATERIAL CONTAINING SAME, AND LUMINESCENT ELEMENT TORAY INDUSTRIES (JP) 2021-08-18 — — EP disclosed
US-9935273-B2 Fluoranthene derivative, light-emitting device material containing same, and light-emitting device TORAY INDUSTRIES, INC. (JP) 2018-04-03 — — US disclosed
US-20150280139-A1 FLUORANTHENE DERIVATIVE, LIGHT-EMITTING DEVICE MATERIAL CONTAINING SAME, AND LIGHT-EMITTING DEVICE TORAY INDUSTRIES, INC. (JP) 2015-10-01 — — US disclosed
US-20150280139-A1 FLUORANTHENE DERIVATIVE, LIGHT-EMITTING DEVICE MATERIAL CONTAINING SAME, AND LIGHT-EMITTING DEVICE TORAY INDUSTRIES, INC. (JP) 2015-10-01 — — US disclosed
EP-2907803-A1 FLUORANTHENE DERIVATIVE, LUMINESCENT ELEMENT MATERIAL CONTAINING SAME, AND LUMINESCENT ELEMENT Toray Industries, Inc. (JP) 2015-08-19 — — EP 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-20150280139-A1 FLUORANTHENE DERIVATIVE, LIGHT-EMITTING DEVICE MATERIAL CONTAINING SAME, AND LIGHT-EMITTING DEVICE FMNL1, AFF2, LEF1 GABRG2 4218/4885GABRB3 4731/4885GABRA5 4255/4885

“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.

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