SCHEMBL17012324

SCHEMBL17012324

c1ccc(N(c2ccc(-c3ccccn3)nc2)c2cccc(-c3ccc4c5c(cccc35)-c3ccccc3-4)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 8/20 0.36
▸ HPGDS O60760 1/20 0.35
▸ WNT1 P04628 1/20 0.35
▸ PIM1 P11309 2/20 0.34
▸ GRM5 P41594 1/20 0.34
▸ CYP11B1 P15538 1/20 0.33
▸ FEN1 P39748 1/20 0.33
▸ MAPK1 P28482 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ TSHR P16473 1/20 0.32
▸ PIM2 Q9P1W9 1/20 0.32
▸ KDM4E B2RXH2 3/20 0.32
▸ LMNA P02545 3/20 0.32
▸ TP53 P04637 2/20 0.32
▸ ALOX15 P16050 2/20 0.32
▸ HTT P42858 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ CCR1 P32246 2/20 0.32
▸ CCR5 P51681 2/20 0.32

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
SCHEMBL17012401 0.95 HPGDS (0.38) TGFBR1HPGDSWNT1PIM1GRM5
SCHEMBL17132518 0.93 HPGDS (0.39) TGFBR1HPGDSWNT1PIM1GRM5
SCHEMBL17012377 0.92 HPGDS (0.38) TGFBR1HPGDSWNT1PIM1GRM5
SCHEMBL16485343 0.92 HPGDS (0.37) TGFBR1HPGDSPIM1GRM5CYP11B1
SCHEMBL17012236 0.91 TGFBR1 (0.34) TGFBR1HPGDSWNT1PIM1GRM5
SCHEMBL17132508 0.91 TGFBR1 (0.38) TGFBR1GRM5CYP11B1MAPK1HSD17B10
SCHEMBL17012323 0.91 CYP11B1 (0.37) HPGDSCYP11B1FEN1MAPK1HSD17B10
SCHEMBL17012319 0.91 PRKDC (0.37) TGFBR1GRM5MAPK1HSD17B10TSHR
SCHEMBL17012388 0.90 TGFBR1 (0.37) TGFBR1WNT1PIM1GRM5MAPK1
SCHEMBL17012321 0.90 TGFBR1 (0.36) TGFBR1GRM5MAPK1HSD17B10TSHR

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 6 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-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 TGFBR1 2930/4885HPGDS 4604/4885WNT1 200/4885

“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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