SCHEMBL4117264

SCHEMBL4117264

Brc1cccc(-n2c3ccccc3c3ncccc32)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.42
MEN1 O00255 4/20 0.42
KDM4E B2RXH2 4/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
ATM Q13315 1/20 0.41
PDE4A P27815 3/20 0.40
DCTPP1 Q9H773 1/20 0.39
EGFR P00533 3/20 0.38
HSP90AA1 P07900 3/20 0.36
HTT P42858 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
TP53 P04637 2/20 0.36
USP2 O75604 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KCNH2 Q12809 2/20 0.36
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
MAT2A P31153 1/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL261961 0.89 KDM4E (0.47) KMT2AMEN1KDM4EL3MBTL1ATM
SCHEMBL16625767 0.85 HTT (0.36) KMT2AMEN1KDM4EL3MBTL1ATM
SCHEMBL9968180 0.85 L3MBTL1 (0.43) KMT2AMEN1KDM4EL3MBTL1ATM
SCHEMBL31273004 0.84 NPC1 (0.35) KMT2AMEN1KDM4EPDE4ADCTPP1
SCHEMBL15855405 0.84 KDM4E (0.42) KMT2AKDM4EL3MBTL1ATMHSP90AA1
SCHEMBL15855402 0.84 KDM4E (0.42) KMT2AKDM4EL3MBTL1ATMHSP90AA1
SCHEMBL23438455 0.83 KDM4E (0.44) KMT2AMEN1KDM4EL3MBTL1ATM
SCHEMBL29853541 0.83 KDM4E (0.44) KMT2AMEN1KDM4EL3MBTL1ATM
SCHEMBL12396559 0.82 L3MBTL1 (0.61) KDM4EL3MBTL1ATMPDE4AHSP90AA1
SCHEMBL12110403 0.82 KDM4E (0.45) KMT2AMEN1KDM4EL3MBTL1ATM

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-11723269-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-08-08 US disclosed
US-20090230857-A1 AROMATIC HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DIODE COMPRISING ORGANIC LAYER COMPRISING THE SAME AND METHOD OF MANUFACTURING THE ORGANIC LIGHT EMITTING DIODE GANGWON NATIONAL UNIVERSITY (KP) 2009-09-17 US disclosed
US-20090230857-A1 AROMATIC HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DIODE COMPRISING ORGANIC LAYER COMPRISING THE SAME AND METHOD OF MANUFACTURING THE ORGANIC LIGHT EMITTING DIODE GANGWON NATIONAL UNIVERSITY (KP) 2009-09-17 US disclosed
US-20090230857-A1 AROMATIC HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DIODE COMPRISING ORGANIC LAYER COMPRISING THE SAME AND METHOD OF MANUFACTURING THE ORGANIC LIGHT EMITTING DIODE GANGWON NATIONAL UNIVERSITY (KP) 2009-09-17 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-11723269-B2 Organic electroluminescent materials and devices PUF60, CD99, DDT KMT2A 2532/4885MEN1 878/4885KDM4E 3163/4885
US-20090230857-A1 AROMATIC HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DIODE COMPRISING ORGANIC LAYER COMPRISING THE SAME AND METHOD OF MANUFACTURING THE ORGANIC LIGHT EMITTING DIODE CYP1A1, CYP1B1, AOX1 KMT2A 1102/4885MEN1 2966/4885KDM4E 1143/4885

“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.