SCHEMBL17017649

SCHEMBL17017649

c1ccc(-c2cc(-c3ccccc3)nc(-c3nc(-n4c5ccccc5c5c6ccn(-c7ccccc7)c6ccc54)nc4ccccc34)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.34
HPGD P15428 4/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.33
LMNA P02545 3/20 0.33
CYP19A1 P11511 2/20 0.32
CYP17A1 P05093 1/20 0.32
CYP11B1 P15538 1/20 0.32
ACHE P22303 1/20 0.32
DHODH Q02127 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.30
PDE10A Q9Y233 1/20 0.30
KMT2A Q03164 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
SCHEMBL17017634 0.90 KDM4E (0.36) KDM4EHPGDALDH1A1MAPTNPSR1
SCHEMBL17017648 0.90 ALDH1A1 (0.40) KDM4EHPGDALDH1A1MAPTNPSR1
SCHEMBL17017697 0.89 KDM4E (0.33) KDM4EHPGDALDH1A1MAPTNPSR1
SCHEMBL15596396 0.88 KDM4E (0.33) KDM4EHPGDALDH1A1MAPTNPSR1
SCHEMBL17017677 0.87 KMT2A (0.32) KDM4EMAPTNPSR1L3MBTL1CYP19A1
SCHEMBL17017668 0.87 KMT2A (0.37) KDM4EHPGDALDH1A1MAPTNPSR1
SCHEMBL17017645 0.87 ALDH1A1 (0.44) KDM4EHPGDALDH1A1MAPTNPSR1
SCHEMBL17017627 0.87 ALDH1A1 (0.46) KDM4EHPGDALDH1A1MAPTNPSR1
SCHEMBL17017632 0.87 ALDH1A1 (0.39) KDM4EHPGDALDH1A1MAPTNPSR1
SCHEMBL15596338 0.85 KDM4E (0.34) KDM4EHPGDALDH1A1MAPTNPSR1

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 KDM4E 849/4885HPGD 3474/4885ALDH1A1 373/4885

“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.