SCHEMBL16484569

SCHEMBL16484569

c1cncc(N(c2ccc(-c3ccc4c5c(cccc35)-c3ccccc3-4)cc2)c2ccc(-c3ccc4c5c(cccc35)-c3ccccc3-4)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.43
CYP11B2 P19099 2/20 0.43
TNF P01375 3/20 0.38
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
PTGS2 P35354 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HDAC6 Q9UBN7 2/20 0.34
DHPS P49366 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
KCNA5 P22460 1/20 0.33
CYP1B1 Q16678 1/20 0.33
CYP17A1 P05093 1/20 0.33

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
SCHEMBL17132493 1.00 CYP11B1 (0.43) CYP11B1CYP11B2TNFCRHBPCRHR2
SCHEMBL16484432 0.99 CYP11B1 (0.42) CYP11B1CYP11B2TNFCRHBPCRHR2
SCHEMBL17012202 0.96 CYP11B1 (0.40) CYP11B1CYP11B2TNFCRHBPCRHR2
SCHEMBL16484599 0.96 CYP11B1 (0.43) CYP11B1CYP11B2TNFCRHBPCRHR2
SCHEMBL16484663 0.96 CYP11B1 (0.43) CYP11B1CYP11B2TNFCRHBPCRHR2
SCHEMBL16484578 0.95 TNF (0.43) CYP11B1CYP11B2TNFALDH1A1HPGD
SCHEMBL16484564 0.93 CYP11B1 (0.40) CYP11B1CYP11B2TNFALDH1A1HPGD
SCHEMBL16485106 0.91 CYP11B1 (0.42) CYP11B1CYP11B2TNFALDH1A1HPGD
SCHEMBL16485344 0.91 CYP11B1 (0.46) CYP11B1CYP11B2TNFALDH1A1HPGD
SCHEMBL16485108 0.91 CYP11B1 (0.40) CYP11B1CYP11B2TNFALDH1A1HPGD

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 7 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
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 CYP11B1 4354/4885CYP11B2 3859/4885TNF 3654/4885

“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.