SCHEMBL861753

SCHEMBL861753

CC(C)(C)Cc1ccc2c(c1)c1ccccc1c1nc3ccc(CC(C)(C)C)cc3n21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.37
MAPT P10636 5/20 0.37
ALDH1A1 P00352 4/20 0.37
HPGD P15428 4/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
LMNA P02545 3/20 0.37
POLB P06746 3/20 0.37
HSD17B10 Q99714 2/20 0.37
TP53 P04637 1/20 0.37
PGR P06401 3/20 0.36
RORA P35398 3/20 0.36
RORC P51449 3/20 0.36
RORB Q92753 3/20 0.36
TSHR P16473 2/20 0.33
AHR P35869 1/20 0.33
PDE2A O00408 4/20 0.33
GAA P10253 2/20 0.33
PKM P14618 1/20 0.33
HIF1A Q16665 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
SCHEMBL26458952 0.94 KDM4E (0.41) KDM4EMAPTALDH1A1HPGDKMT2A
SCHEMBL15428293 0.84 KDM4E (0.32) KDM4EMAPTALDH1A1HPGDKMT2A
SCHEMBL19743170 0.79 KDM4E (0.50) KDM4EMAPTALDH1A1HPGDKMT2A
SCHEMBL22113792 0.78 PTGER4 (0.38) KDM4EMAPTALDH1A1HPGDKMT2A
SCHEMBL18069015 0.77 KDM4E (0.56) KDM4EMAPTALDH1A1HPGDKMT2A
SCHEMBL861579 0.76 PGR (0.33) KDM4EMAPTKMT2AMEN1LMNA
SCHEMBL19735270 0.76 KDM4E (0.43) KDM4EMAPTALDH1A1HPGDKMT2A
SCHEMBL23185047 0.76 PGR (0.39) KDM4EMAPTALDH1A1HPGDKMT2A
SCHEMBL861304 0.75 PGR (0.32) KMT2AMEN1PGRRORARORC
SCHEMBL861778 0.74 PTAFR (0.38) KDM4EALDH1A1HPGDKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150311455-A1 Method Of Forming Metal Complex Compound, And Organic Electroluminescence Device UDC IRELAND LTD (IE) 2015-10-29 US disclosed
US-20150311455-A1 Method Of Forming Metal Complex Compound, And Organic Electroluminescence Device UDC IRELAND LTD (IE) 2015-10-29 US disclosed
US-9062084-B2 Method of forming metal complex compound, and organic electroluminescence device UDC Ireland (IE) 2015-06-23 US disclosed
US-9062084-B2 Method of forming metal complex compound, and organic electroluminescence device UDC Ireland (IE) 2015-06-23 US disclosed
US-8142909-B2 Blue phosphorescent imidazophenanthridine materials UNIVERSAL DISPLAY CORPORATION (US) 2012-03-27 US disclosed
US-8142909-B2 Blue phosphorescent imidazophenanthridine materials UNIVERSAL DISPLAY CORPORATION (US) 2012-03-27 US disclosed
US-20110050093-A1 METHOD OF FORMING METAL COMPLEX COMPOUND, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2011-03-03 US disclosed
US-20110050093-A1 METHOD OF FORMING METAL COMPLEX COMPOUND, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2011-03-03 US disclosed
WO-2008156879-A1 BLUE PHOSPHORESCENT IMIDAZOPHENANTHRIDINE MATERIALS UNIVERSAL DISPLAY CORPORATION (US) 2008-12-24 WO disclosed
US-20080297033-A1 BLUE PHOSPHORESCENT IMIDAZOPHENANTHRIDINE MATERIALS UNIVERSAL DISPLAY CORPORATION 2008-12-04 US disclosed
US-20080297033-A1 BLUE PHOSPHORESCENT IMIDAZOPHENANTHRIDINE MATERIALS UNIVERSAL DISPLAY CORPORATION 2008-12-04 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 (3 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-20110050093-A1 METHOD OF FORMING METAL COMPLEX COMPOUND, AND ORGANIC ELECTROLUMINESCENCE DEVICE ZFR, PORCN, OR10J3 KDM4E 2514/4885MAPT 1946/4885ALDH1A1 2296/4885
US-20150311455-A1 Method Of Forming Metal Complex Compound, And Organic Electroluminescence Device ZFR, PORCN, OR10J3 KDM4E 2514/4885MAPT 1946/4885ALDH1A1 2296/4885
US-20080297033-A1 BLUE PHOSPHORESCENT IMIDAZOPHENANTHRIDINE MATERIALS IK, CRY1, MAP1LC3C KDM4E 3612/4885MAPT 996/4885ALDH1A1 1365/4885

“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.