SCHEMBL18564682

SCHEMBL18564682

CN(c1ccccc1)c1ccc(-c2ccc(-c3ccc4c(c3)c3c5ccccc5ccc3n4-c3ccccc3)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ATM Q13315 1/20 0.37
JAK2 O60674 1/20 0.34
JAK3 P52333 1/20 0.34
REN P00797 1/20 0.34
TSPO P30536 1/20 0.33
FAAH O00519 1/20 0.33
PTGES O14684 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
SIRT1 Q96EB6 1/20 0.32
ITK Q08881 1/20 0.32
PDE5A O76074 2/20 0.32
CHKA P35790 1/20 0.32
ALDH1A1 P00352 2/20 0.31
DHFR P00374 1/20 0.31
MEN1 O00255 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL18564755 1.00 KDM4E (0.37) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL18564786 0.96 TSPO (0.35) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL18564793 0.96 TSPO (0.35) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL18564920 0.94 TSPO (0.34) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL18564954 0.94 TSPO (0.34) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL19735337 0.93 KDM4E (0.37) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL18566259 0.92 MAPK9 (0.32) TSPOFAAHPTGESITKALDH1A1
SCHEMBL18565025 0.92 MAPK9 (0.32) TSPOFAAHPTGESITKALDH1A1
SCHEMBL12249658 0.92 KDM4E (0.35) KDM4EL3MBTL1ATMJAK2JAK3
SCHEMBL18564787 0.92 PDE5A (0.36) KDM4EL3MBTL1ATMJAK2JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10290815-B2 Composition, compound, material for organic electroluminescence element, ink composition, organic electroluminescence element, and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2019-05-14 US disclosed
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-03-02 US disclosed
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-03-02 US 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 (2 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-10290815-B2 Composition, compound, material for organic electroluminescence element, ink composition, organic electroluminescence element, and electronic device EED, BMI1, CD99 KDM4E 225/4885L3MBTL1 1263/4885ATM 3092/4885
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE EED, BMI1, CD99 KDM4E 225/4885L3MBTL1 1263/4885ATM 3092/4885

“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.