SCHEMBL16484266

SCHEMBL16484266

c1ccc(-n2c3c(ccc4c3c3ccccc3n4-c3cccc(-c4ccccn4)c3)c3ccc4c(c5ncccc5n4-c4cccc(-c5ccccn5)c4)c32)cc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.38
HTR7 P34969 1/20 0.38
GRM5 P41594 6/20 0.35
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MCL1 Q07820 2/20 0.34
DHFR P00374 1/20 0.33
MAPK14 Q16539 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
PTGER1 P34995 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
SCHEMBL16484264 0.94 GRM5 (0.41) HTR1AHTR7GRM5MCL1DHFR
SCHEMBL17109006 0.92 GRM5 (0.42) HTR1AHTR7GRM5KDM4EATM
SCHEMBL9955519 0.88 HTR1A (0.43) HTR1AHTR7GRM5KDM4EATM
SCHEMBL21453997 0.87 L3MBTL1 (0.42) GRM5KDM4EATML3MBTL1ALDH1A1
SCHEMBL16485710 0.87 KDM4E (0.45) KDM4EATML3MBTL1ALDH1A1TSHR
SCHEMBL17109004 0.86 HTR1A (0.33) HTR1AHTR7GRM5
SCHEMBL17248289 0.86 HTR1A (0.47) HTR1AHTR7GRM5KDM4EATM
SCHEMBL15857153 0.85 HTR1A (0.36) HTR1AHTR7GRM5KDM4EATM
SCHEMBL16484272 0.85 KDM4E (0.42) KDM4EATML3MBTL1ALDH1A1TSHR
SCHEMBL17108998 0.85 KDM4E (0.33) KDM4EATML3MBTL1MCL1MAPK14

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-9960364-B2 Ladder compound, and organic electroluminescent element using same IDEMITSU KOSAN CO., LTD. (JP) 2018-05-01 US disclosed
US-9960364-B2 Ladder compound, and organic electroluminescent element using same IDEMITSU KOSAN CO., LTD. (JP) 2018-05-01 US disclosed
US-20150270496-A1 LADDER COMPOUND, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME IDEMIITSU KOSAN CO., LTD. (JP) 2015-09-24 US disclosed
US-20150270496-A1 LADDER COMPOUND, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME IDEMIITSU KOSAN CO., LTD. (JP) 2015-09-24 US disclosed
WO-2014057684-A1 LADDER COMPOUND, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 出光興産株式会社 (JP) 2014-04-17 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 (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-20150270496-A1 LADDER COMPOUND, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME YBX1, ATXN2L, ATXN2 HTR1A 1317/4885HTR7 2019/4885GRM5 2345/4885

“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.