SCHEMBL21566444

SCHEMBL21566444

c1ccc(-c2ccc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5cccc6ccccc56)c43)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 1/20 0.34
HDAC4 P56524 1/20 0.34
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
KMT2A Q03164 2/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
IL1R1 P14778 1/20 0.32
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
GSR P00390 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
SCHEMBL23233689 1.00 PDE6D (0.39) PDE6DL3MBTL1KDM4EATMALDH1A1
SCHEMBL19769609 0.96 KDM4E (0.39) PDE6DL3MBTL1KDM4EATMALDH1A1
SCHEMBL21566447 0.96 L3MBTL1 (0.42) PDE6DL3MBTL1KDM4EATMALDH1A1
SCHEMBL23232219 0.96 L3MBTL1 (0.42) PDE6DL3MBTL1KDM4EATMALDH1A1
SCHEMBL23862349 0.93 L3MBTL1 (0.39) PDE6DL3MBTL1KDM4EATMALDH1A1
SCHEMBL12690893 0.93 ATM (0.35) PDE6DL3MBTL1KDM4EATMALDH1A1
SCHEMBL17245392 0.92 KDM4E (0.46) L3MBTL1KDM4EATMALDH1A1TDP1
SCHEMBL19769675 0.92 KDM4E (0.40) PDE6DL3MBTL1KDM4EATMALDH1A1
SCHEMBL19769622 0.92 KDM4E (0.40) PDE6DL3MBTL1KDM4EATMALDH1A1
SCHEMBL24356706 0.92 ATM (0.36) PDE6DL3MBTL1KDM4EATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230136708-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2023-05-04 US disclosed
US-20230136708-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2023-05-04 US disclosed
WO-2022086296-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-04-28 WO disclosed
US-20210111350-A1 PHOSPHORESCENT HOST COMPOSITION, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2021-04-15 US disclosed
US-20190348612-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2019-11-14 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-20190348612-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OCIAD2, OR10J3, OCIAD1 PDE6D 61/4885L3MBTL1 4726/4885KDM4E 3780/4885
US-20210111350-A1 PHOSPHORESCENT HOST COMPOSITION, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE ORC3, CRY1, OSTC PDE6D 280/4885L3MBTL1 4140/4885KDM4E 4468/4885

“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.