SCHEMBL4546844

SCHEMBL4546844

Cc1cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
ATM Q13315 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
AKR1C4 P17516 1/20 0.42
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42
AKR1C1 Q04828 1/20 0.42
HDAC4 P56524 1/20 0.41
MAPT P10636 3/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
GPR3 P46089 1/20 0.35
POLB P06746 2/20 0.34
BRD9 Q9H8M2 1/20 0.34
BRD7 Q9NPI1 1/20 0.34
ALDH1A1 P00352 4/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
BRCA1 P38398 1/20 0.34

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
SCHEMBL12346091 0.93 KDM4E (0.53) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL25693022 0.93 KDM4E (0.52) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL29351241 0.92 L3MBTL1 (0.52) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL4546816 0.92 L3MBTL1 (0.52) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL12414454 0.92 KDM4E (0.52) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL4546841 0.91 KDM4E (0.50) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL13238025 0.91 AKR1C4 (0.44) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL4546819 0.90 L3MBTL1 (0.55) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL4546820 0.90 L3MBTL1 (0.55) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL19271510 0.88 L3MBTL1 (0.52) KDM4EATML3MBTL1AKR1C4AKR1C3

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-8178215-B2 Organic compound containing at least two carbazolyl-substituted phenyl structures; charge-transporting material and organic el element containing the compound PIONEER CORPORATION (JP) 2012-05-15 US disclosed
US-8178215-B2 Organic compound containing at least two carbazolyl-substituted phenyl structures; charge-transporting material and organic el element containing the compound PIONEER CORPORATION (JP) 2012-05-15 US disclosed
US-7993763-B2 Emissive core of an iridium atom and ligands coordinated to the metal atom; a host group with two rings or a heteroaryl group with two rings and a terminal alkyl group, a heteroalkyl group, an aryl group, or a heteroaryl group; organic phototransistors, organic photovoltaic cells UNIVERSAL DISPLAY CORPORATION (US) 2011-08-09 US disclosed
US-20090236973-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, AND ORGANIC ELECTROLUMINESCENT ELEMENT PIONEER CORPORATION (JO) 2009-09-24 US disclosed
US-20090236973-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, AND ORGANIC ELECTROLUMINESCENT ELEMENT PIONEER CORPORATION (JO) 2009-09-24 US disclosed
US-20080280163-A1 Organometallic compounds having host and dopant functionalities UNIVERSAL DISPLAY CORPORATION 2008-11-13 US disclosed
EP-1820801-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, AND ORGANIC ELECTROLUMINESCENT ELEMENT Pioneer Corporation (JP) 2007-08-22 EP 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-20090236973-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, AND ORGANIC ELECTROLUMINESCENT ELEMENT SLCO4C1, SLCO2A1, SLCO2B1 KDM4E 2187/4885ATM 4266/4885L3MBTL1 702/4885
US-20080280163-A1 Organometallic compounds having host and dopant functionalities PNMT, DDT, TYR KDM4E 3850/4885ATM 3778/4885L3MBTL1 835/4885

“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.