SCHEMBL10015252

SCHEMBL10015252

c1ccc2c(c1)c1ccccc1n2-c1cc(-c2cncc(-c3cc(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5ccccc54)c3)c2)cc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
ATM Q13315 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
KDR P35968 4/20 0.34
CYP11B2 P19099 2/20 0.33
MKNK1 Q9BUB5 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
LRRK2 Q5S007 1/20 0.33
DUSP3 P51452 1/20 0.33
GPR3 P46089 1/20 0.33
CYP11B1 P15538 1/20 0.33
MAOA P21397 4/20 0.33
MAOB P27338 4/20 0.33
ACHE P22303 1/20 0.33
SLC6A2 P23975 1/20 0.33
CYP2A6 P11509 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
SCHEMBL11987869 0.95 KDM4E (0.47) KDM4EATML3MBTL1CHRNB4CHRNA3
SCHEMBL11987847 0.94 KDM4E (0.47) KDM4EATML3MBTL1CHRNB4CHRNA3
SCHEMBL11987852 0.94 KDM4E (0.47) KDM4EATML3MBTL1CHRNB4CHRNA3
SCHEMBL612850 0.89 KDM4E (0.52) KDM4EATML3MBTL1CHRNB4CHRNA3
SCHEMBL12861441 0.89 KDM4E (0.42) KDM4EATML3MBTL1CYP11B2CYP11B1
SCHEMBL10015301 0.89 KDM4E (0.42) KDM4EATML3MBTL1CHRNB4CHRNA3
SCHEMBL16605606 0.89 L3MBTL1 (0.60) KDM4EATML3MBTL1GPR3
SCHEMBL12754466 0.89 L3MBTL1 (0.60) KDM4EATML3MBTL1GPR3
SCHEMBL13144266 0.89 L3MBTL1 (0.60) KDM4EATML3MBTL1GPR3
SCHEMBL11987850 0.88 KDM4E (0.39) KDM4EATML3MBTL1CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8120243-B2 Material for organic photoelectric device, and organic photoelectric device thereby CHEIL INDUSTRIES, INC. (KR) 2012-02-21 US disclosed
US-8120243-B2 Material for organic photoelectric device, and organic photoelectric device thereby CHEIL INDUSTRIES, INC. (KR) 2012-02-21 US disclosed
US-20120012830-A1 MATERIAL FOR ORGANIC PHOTOELECTRIC DEVICE, AND ORGANIC PHOTOELECTRIC DEVICE THEREBY CHEIL INDUSTRIES, INC. (KR) 2012-01-19 US disclosed
US-20120012830-A1 MATERIAL FOR ORGANIC PHOTOELECTRIC DEVICE, AND ORGANIC PHOTOELECTRIC DEVICE THEREBY CHEIL INDUSTRIES, INC. (KR) 2012-01-19 US disclosed
US-20100213826-A1 Material for organic photoelectric device, and organic photoelectric device thereby CHEIL INDUSTRIES, INC. (KR) 2010-08-26 US disclosed
US-20100213826-A1 Material for organic photoelectric device, and organic photoelectric device thereby CHEIL INDUSTRIES, INC. (KR) 2010-08-26 US disclosed
WO-2009057978-A2 MATERIAL FOR ORGANIC PHOTOELECTRIC DEVICE, AND ORGANIC PHOTOELECTRIC DEVICE THEREBY CHEIL INDUSTRIES INC. (KR) 2009-05-07 WO 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-20100213826-A1 Material for organic photoelectric device, and organic photoelectric device thereby HCN1, HCN2, HCN4 KDM4E 4279/4885ATM 4104/4885L3MBTL1 1724/4885
US-20120012830-A1 MATERIAL FOR ORGANIC PHOTOELECTRIC DEVICE, AND ORGANIC PHOTOELECTRIC DEVICE THEREBY HCN1, HCN2, HCN4 KDM4E 4279/4885ATM 4104/4885L3MBTL1 1724/4885

“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.