SCHEMBL17017682

SCHEMBL17017682

c1ccc(-n2ccc3c4c5ccccc5n(-c5cccc(-c6nc(-c7ccc(-c8cccc9ccccc89)cc7)c7ccccc7n6)c5)c4ccc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
ATM Q13315 1/20 0.38
SETD7 Q8WTS6 1/20 0.34
EHMT2 Q96KQ7 1/20 0.34
FLT3 P36888 3/20 0.32
BMX P51813 2/20 0.32
WHR1 P49842 1/20 0.32
DHODH Q02127 1/20 0.32
PDE10A Q9Y233 1/20 0.32
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
PDE5A O76074 1/20 0.30
ABCG2 Q9UNQ0 2/20 0.30
MAPT P10636 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL17017829 0.94 MEN1 (0.36) MEN1KMT2AATMSETD7EHMT2
SCHEMBL17017683 0.94 ALDH1A1 (0.34) MEN1KMT2AATMFLT3BMX
SCHEMBL17017660 0.93 ATM (0.39) MEN1KMT2AATMSETD7EHMT2
SCHEMBL17017681 0.93 MEN1 (0.42) MEN1KMT2AATMWHR1PDE10A
SCHEMBL17017675 0.92 MEN1 (0.41) MEN1KMT2AATMWHR1PDE10A
SCHEMBL17017692 0.91 MEN1 (0.33) MEN1KMT2AATMSETD7EHMT2
SCHEMBL17017774 0.90 MEN1 (0.36) MEN1KMT2AATMFLT3BMX
SCHEMBL15596429 0.89 MEN1 (0.36) MEN1KMT2AATMSETD7EHMT2
SCHEMBL17017689 0.89 MEN1 (0.38) MEN1KMT2AATMWHR1PDE10A
SCHEMBL17017672 0.89 MEN1 (0.37) MEN1KMT2AATMWHR1ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9905777-B2 Compound and organic electroluminescence device comprising same DOOSAN CORPORATION (KR) 2018-02-27 US disclosed
US-9905777-B2 Compound and organic electroluminescence device comprising same DOOSAN CORPORATION (KR) 2018-02-27 US disclosed
US-20150236271-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING SAME DOOSAN CORPORATION (KR) 2015-08-20 US disclosed
US-20150236271-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING SAME DOOSAN CORPORATION (KR) 2015-08-20 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 (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-20150236271-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING SAME OR10J3, VDAC1, VDAC2 MEN1 1762/4885KMT2A 1420/4885ATM 3382/4885

“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.