SCHEMBL16485288

SCHEMBL16485288

c1cc2c3c(cccc3c1)-c1cc3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccncc4)ccc3cc1-2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.41
▸ HPGD P15428 3/20 0.41
▸ TSHR P16473 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ CASP1 P29466 2/20 0.41
▸ HIF1A Q16665 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CASP7 P55210 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ MAPK10 P53779 9/20 0.38
▸ MAPK9 P45984 8/20 0.38
▸ MAPK8 P45983 3/20 0.38
▸ KCNH2 Q12809 1/20 0.36
▸ PDE10A Q9Y233 1/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ ATM Q13315 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ HSP90AA1 P07900 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
SCHEMBL16485262 0.91 ALDH1A1 (0.40) ALDH1A1HPGDTSHRMAPK1CASP1
SCHEMBL16485286 0.88 MAPK1 (0.42) ALDH1A1HPGDTSHRMAPK1CASP1
SCHEMBL16485260 0.87 ALDH1A1 (0.36) ALDH1A1HPGDTSHRMAPK1CASP1
SCHEMBL20016830 0.86 MAPK1 (0.34) ALDH1A1HPGDTSHRMAPK1CASP1
SCHEMBL17953712 0.85 L3MBTL1 (0.44) ALDH1A1HPGDTSHRMAPK1CASP1
SCHEMBL17690369 0.84 KDM4E (0.43) ALDH1A1HPGDMAPK1HSD17B10KDM4E
SCHEMBL16485284 0.83 ALDH1A1 (0.42) ALDH1A1HPGDTSHRMAPK1CASP1
SCHEMBL17953884 0.81 KDM4E (0.38) ALDH1A1HPGDTSHRMAPK1CASP1
SCHEMBL16641548 0.81 KDM4E (0.52) ALDH1A1KDM4EL3MBTL1ATMMEN1
SCHEMBL17953664 0.81 L3MBTL1 (0.47) ALDH1A1HPGDTSHRMAPK1CASP1

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-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
WO-2014057874-A1 FLUORANTHENE DERIVATIVE, LUMINESCENT ELEMENT MATERIAL CONTAINING SAME, AND LUMINESCENT ELEMENT 東レ株式会社 (JP) 2014-04-17 — — WO 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 ALDH1A1 1031/4885HPGD 3245/4885TSHR 4531/4885

“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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