SCHEMBL16484501

SCHEMBL16484501

c1ccc(N(c2ccccc2)c2cccc(-c3cccnc3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 4/20 0.54
ALDH1A1 P00352 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
MEN1 O00255 1/20 0.53
PSIP1 O75475 1/20 0.53
AXL P30530 1/20 0.53
MKNK1 Q9BUB5 1/20 0.53
MKNK2 Q9HBH9 1/20 0.53
CYP19A1 P11511 4/20 0.51
CYP11B1 P15538 4/20 0.51
CYP11B2 P19099 4/20 0.51
CYP17A1 P05093 1/20 0.51
KMO O15229 1/20 0.51
FYN P06241 1/20 0.47
FGFR1 P11362 1/20 0.45
EPHX2 P34913 1/20 0.45
PRMT6 Q96LA8 1/20 0.45
QPCT Q16769 1/20 0.44
QPCTL Q9NXS2 1/20 0.44

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
SCHEMBL12130070 0.95 MKNK1 (0.49) CYP2A6ALDH1A1CYP1A2CYP3A4MEN1
SCHEMBL10040769 0.93 CYP2A6 (0.58) CYP2A6ALDH1A1CYP1A2CYP3A4MEN1
SCHEMBL14926294 0.91 CYP11B1 (0.51) CYP2A6ALDH1A1CYP1A2CYP3A4MEN1
SCHEMBL12259267 0.87 CYP11B1 (0.43) CYP2A6ALDH1A1CYP1A2CYP3A4MEN1
SCHEMBL18090365 0.86 CYP11B1 (0.47) CYP2A6ALDH1A1CYP1A2CYP3A4MEN1
SCHEMBL612553 0.85 CHRNA7 (0.44) CYP2A6ALDH1A1CYP1A2CYP3A4MEN1
SCHEMBL2262911 0.85 CYP2A6 (0.58) CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1
SCHEMBL16484496 0.85 CYP2A6 (0.58) CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1
SCHEMBL17752879 0.85 CYP11B1 (0.46) CYP2A6ALDH1A1CYP1A2CYP3A4MEN1
SCHEMBL16485363 0.84 CYP11B1 (0.45) CYP2A6ALDH1A1CYP1A2CYP3A4MEN1

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
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
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 CYP2A6 2007/4885ALDH1A1 1031/4885CYP1A2 563/4885

“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.