SCHEMBL3092289

SCHEMBL3092289

COC(=O)c1cc(C)c(OC(=O)c2c3ccccc3nc3ccccc23)c(C)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
PPARA Q07869 1/20 0.49
KDM4E B2RXH2 6/20 0.48
MAPT P10636 6/20 0.48
POLB P06746 3/20 0.48
ALDH1A1 P00352 3/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
TDP1 Q9NUW8 3/20 0.45
RXFP1 Q9HBX9 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
TNKS O95271 1/20 0.43
PDE5A O76074 2/20 0.43
ABCC1 P33527 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
TSHR P16473 1/20 0.42
TP53 P04637 1/20 0.42
HTT P42858 1/20 0.42
PLIN1 O60240 1/20 0.42

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
SCHEMBL12088076 0.92 MEN1 (0.48) MEN1KMT2APPARAKDM4EMAPT
SCHEMBL14160646 0.91 MEN1 (0.46) MEN1KMT2APPARAKDM4EMAPT
SCHEMBL10091833 0.89 MEN1 (0.44) MEN1KMT2APPARAKDM4EMAPT
SCHEMBL23685784 0.88 PPARA (0.45) MEN1KMT2APPARAKDM4EMAPT
SCHEMBL7050086 0.88 MEN1 (0.44) MEN1KMT2AKDM4EMAPTPOLB
SCHEMBL15413120 0.87 KMT2A (0.48) MEN1KMT2AKDM4EMAPTPOLB
SCHEMBL10091841 0.87 PPARA (0.46) MEN1KMT2APPARAKDM4EMAPT
SCHEMBL12088158 0.86 MEN1 (0.41) MEN1KMT2APPARAKDM4EMAPT
SCHEMBL10091826 0.85 PPARA (0.42) MEN1KMT2APPARAKDM4EMAPT
SCHEMBL10091840 0.85 PPARA (0.42) MEN1KMT2APPARAKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2872489-B1 SYNTHESIS OF ACRIDINIUM COMPOUNDS BY N-ALKYLATION OF ACRIDANS SIEMENS HEALTHCARE DIAGNOSTICS INC (US) 2016-12-21 EP disclosed
US-9512080-B2 Synthesis of acridinium compounds by N-alkylation of acridans SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2016-12-06 US disclosed
US-9512080-B2 Synthesis of acridinium compounds by N-alkylation of acridans SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2016-12-06 US disclosed
CN-101918367-B Acridine compounds Facile N-alkylation in ionic liquid 西门子医疗保健诊断公司 2016-08-24 CN disclosed
US-20150197491-A1 SYNTHESIS OF ACRIDINIUM COMPOUNDS BY N-ALKYLATION OF ACRIDANS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2015-07-16 US disclosed
US-20150197491-A1 SYNTHESIS OF ACRIDINIUM COMPOUNDS BY N-ALKYLATION OF ACRIDANS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2015-07-16 US disclosed
EP-2872489-A1 SYNTHESIS OF ACRIDINIUM COMPOUNDS BY N-ALKYLATION OF ACRIDANS Siemens Healthcare Diagnostics Inc. (US) 2015-05-20 EP disclosed
WO-2014011762-A1 SYNTHESIS OF ACRIDINIUM COMPOUNDS BY N-ALKYLATION OF ACRIDANS SIEMENS HEAL THCARE DIAGNOSTICS INC. (US) 2014-01-16 WO disclosed
EP-2215063-B1 FACILE N-ALKYLATION OF ACRIDINE COMPOUNDS IN IONIC LIQUIDS SIEMENS HEALTHCARE DIAGNOSTICS (US) 2013-10-30 EP disclosed
US-8293908-B2 Facile N-alkylation of acridine compounds in ionic liquids SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2012-10-23 US disclosed
US-20100256380-A1 FACILE N-ALKYLATION OF ACRIDINE COMPOUNDS IN IONIC LIQUIDS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2010-10-07 US disclosed
EP-2215063-A1 FACILE N-ALKYLATION OF ACRIDINE COMPOUNDS IN IONIC LIQUIDS Siemens Healthcare Diagnostics Inc. (US) 2010-08-11 EP disclosed
WO-2009067417-A1 FACILE N-ALKYLATION OF ACRIDINE COMPOUNDS IN IONIC LIQUIDS SIEMENS HEATHCARE DIAGNOSTICS INC. (US) 2009-05-28 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-20100256380-A1 FACILE N-ALKYLATION OF ACRIDINE COMPOUNDS IN IONIC LIQUIDS ACR, MGMT, DNMT3A MEN1 1088/4885KMT2A 1190/4885PPARA 2876/4885
US-20150197491-A1 SYNTHESIS OF ACRIDINIUM COMPOUNDS BY N-ALKYLATION OF ACRIDANS ACR, MCL1, MGMT MEN1 983/4885KMT2A 1929/4885PPARA 3277/4885

“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.