SCHEMBL17017673

SCHEMBL17017673

c1ccc(-c2cc(-c3ccccc3)nc(-c3nc(-c4ccc(-n5c6ccccc6c6c7ccn(-c8ccccc8)c7ccc65)cc4)nc4ccccc34)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.38
MEN1 O00255 4/20 0.38
ATM Q13315 2/20 0.38
MAPT P10636 5/20 0.38
NPSR1 Q6W5P4 2/20 0.38
PTK2B Q14289 1/20 0.38
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
ABCG2 Q9UNQ0 3/20 0.34
NTSR1 P30989 1/20 0.34
KDM4E B2RXH2 4/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP1A2 P05177 2/20 0.32
POLB P06746 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
THRB P10828 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL17017663 0.94 KMT2A (0.43) KMT2AMEN1ATMMAPTNPSR1
SCHEMBL17017668 0.92 KMT2A (0.37) KMT2AMEN1ATMMAPTNPSR1
SCHEMBL17017678 0.92 KMT2A (0.33) KMT2AMEN1ATMMAPTNPSR1
SCHEMBL15213708 0.92 KMT2A (0.40) KMT2AMEN1ATMMAPTNPSR1
SCHEMBL16357414 0.92 KMT2A (0.40) KMT2AMEN1ATMMAPTNPSR1
SCHEMBL17017637 0.91 KMT2A (0.47) KMT2AMEN1ATMMAPTNPSR1
SCHEMBL17017653 0.90 KMT2A (0.46) KMT2AMEN1ATMMAPTNPSR1
SCHEMBL17017746 0.90 KMT2A (0.36) KMT2AMEN1ATMMAPTNPSR1
SCHEMBL17017664 0.89 KMT2A (0.41) KMT2AMEN1ATMMAPTNPSR1
SCHEMBL15596590 0.89 KMT2A (0.37) KMT2AMEN1ATMMAPTNPSR1

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 KMT2A 1420/4885MEN1 1762/4885ATM 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.