SCHEMBL12088158

SCHEMBL12088158

COC(=O)c1cc(C)c(OC(=O)c2c3ccccc3nc3ccc(CN(C)C)cc23)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
PPARA Q07869 1/20 0.39
MAPT P10636 10/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
BLM P54132 1/20 0.39
ATM Q13315 1/20 0.39
PLA2G2A P14555 3/20 0.38
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 2/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 4/20 0.37
RXFP1 Q9HBX9 1/20 0.36
TP53 P04637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL3092289 0.86 MEN1 (0.52) MEN1KMT2APPARAMAPTL3MBTL1
SCHEMBL12088076 0.83 MEN1 (0.48) MEN1KMT2APPARAMAPTL3MBTL1
SCHEMBL12088068 0.82 HRH3 (0.41) MEN1KMT2AHTTPLA2G2AKDM4E
SCHEMBL16141110 0.81 PLA2G2A (0.40) KMT2AMAPTPLA2G2AKDM4EALDH1A1
SCHEMBL16141112 0.81 PLA2G2A (0.40) KMT2AMAPTPLA2G2AKDM4EALDH1A1
SCHEMBL14160646 0.80 MEN1 (0.46) MEN1KMT2APPARAMAPTL3MBTL1
SCHEMBL23685784 0.80 PPARA (0.45) MEN1KMT2APPARAMAPTL3MBTL1
SCHEMBL10091833 0.79 MEN1 (0.44) MEN1KMT2APPARAMAPTL3MBTL1
SCHEMBL15413120 0.78 KMT2A (0.48) MEN1KMT2AMAPTGAABLM
SCHEMBL3039691 0.78 KDM4E (0.47) MEN1KMT2APPARAMAPTGAA

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-9575062-B2 Zwitterion-containing acridinium compounds SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2017-02-21 US disclosed
US-9575062-B2 Zwitterion-containing acridinium compounds SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2017-02-21 US disclosed
EP-3067345-A1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS Siemens Healthcare Diagnostics Inc. (US) 2016-09-14 EP disclosed
EP-2501681-B1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS SIEMENS HEALTHCARE DIAGNOSTICS (US) 2016-05-25 EP disclosed
US-20140295575-A1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2014-10-02 US disclosed
US-20140295575-A1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2014-10-02 US disclosed
US-8778624-B2 Zwitterion-containing acridinium compounds SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2014-07-15 US disclosed
US-8778624-B2 Zwitterion-containing acridinium compounds SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2014-07-15 US disclosed
US-20120225497-A1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2012-09-06 US disclosed
US-20120225497-A1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2012-09-06 US disclosed
WO-2011060228-A1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2011-05-19 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-20120225497-A1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS ACR, SSB, FCGR3B MEN1 3495/4885KMT2A 4345/4885PPARA 3880/4885

“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.