SCHEMBL17451672

SCHEMBL17451672

c1ccc(-n2c3ccccc3c3c4c5ccccc5n(-c5cccc6ccccc56)c4c4ccccc4c32)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ATM Q13315 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
GSK3A P49840 1/20 0.38
GSK3B P49841 1/20 0.38
POLB P06746 1/20 0.37
ALDH1A1 P00352 5/20 0.36
HPGD P15428 2/20 0.36
GSR P00390 1/20 0.36
TSHR P16473 2/20 0.36
NPC1 O15118 1/20 0.36
MAPK1 P28482 1/20 0.36
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
CYP1A2 P05177 1/20 0.36
HTR1A P08908 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL17445357 0.97 KDM4E (0.46) KDM4EATML3MBTL1CNR1CNR2
SCHEMBL17989785 0.92 KDM4E (0.44) KDM4EATML3MBTL1CNR1CNR2
SCHEMBL17245478 0.92 KDM4E (0.44) KDM4EATML3MBTL1CNR1CNR2
SCHEMBL21109025 0.92 KDM4E (0.47) KDM4EATML3MBTL1CNR1CNR2
SCHEMBL17245479 0.90 KDM4E (0.48) KDM4EATML3MBTL1CNR1CNR2
SCHEMBL17245392 0.90 KDM4E (0.46) KDM4EATML3MBTL1CNR1CNR2
SCHEMBL15073727 0.89 KDM4E (0.49) KDM4EATML3MBTL1CNR1CNR2
SCHEMBL15073684 0.89 KDM4E (0.55) KDM4EATML3MBTL1CNR1CNR2
SCHEMBL17228250 0.89 KDM4E (0.55) KDM4EATML3MBTL1CNR1CNR2
SCHEMBL23741500 0.88 TDP1 (0.41) KDM4EATML3MBTL1CNR1CNR2

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-9799835-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2017-10-24 US disclosed
US-9799835-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2017-10-24 US disclosed
US-20160020410-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2016-01-21 US disclosed
US-20160020410-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2016-01-21 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-20160020410-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF OR51E2, NFE2L2, ORAI2 KDM4E 458/4885ATM 2254/4885L3MBTL1 1059/4885

“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.