SCHEMBL300142

SCHEMBL300142

O=[N+]([O-])c1ccc(Nc2cccc(F)c2)c2nonc12

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.72
KMT2A Q03164 9/20 0.72
MYC P01106 7/20 0.72
IDO1 P14902 5/20 0.72
ARNT P27540 2/20 0.67
EPAS1 Q99814 2/20 0.67
MAX P61244 3/20 0.58
PSMD14 O00487 1/20 0.58
MAPT P10636 1/20 0.58
RXFP1 Q9HBX9 1/20 0.58
POLB P06746 1/20 0.57
GAA P10253 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
TDO2 P48775 1/20 0.53

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
SCHEMBL6831385 0.86 MEN1 (0.74) MEN1KMT2AMYCIDO1ARNT
SCHEMBL300460 0.85 KMT2A (0.73) MEN1KMT2AMYCIDO1MAX
SCHEMBL6831350 0.85 MEN1 (0.73) MEN1KMT2AMYCIDO1MAX
SCHEMBL15931647 0.85 MEN1 (0.72) MEN1KMT2AMYCIDO1MAX
SCHEMBL300082 0.84 IDO1 (0.76) MEN1KMT2AMYCIDO1MAX
SCHEMBL3712058 0.84 MEN1 (1.00) MEN1KMT2AMYCIDO1MAX
SCHEMBL16139683 0.84 MEN1 (0.79) MEN1KMT2AMYCIDO1MAX
SCHEMBL17934470 0.82 MEN1 (0.69) MEN1KMT2AMYCIDO1ARNT
SCHEMBL16107848 0.82 MYC (1.00) MEN1KMT2AMYCIDO1MAX
SCHEMBL14933658 0.81 MEN1 (0.59) MEN1KMT2AMYCIDO1MAX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9566284-B2 Agents and methods for treating ischemic and other diseases NONO INC. (CA) 2017-02-14 US disclosed
US-20140235619-A1 AGENTS AND METHODS FOR TREATING ISCHEMIC AND OTHER DISEASES NONO INC. (CA) 2014-08-21 US disclosed
US-20120122896-A1 2,1,3-BENZOXADIAZOL DERIVATIVES FOR THE INHIBITION OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION PIKE PHARMA GMBH (CH) 2012-05-17 US disclosed
EP-2427442-A1 2,1,3-BENZOXADIAZOL DERIVATIVES FOR THE INHIBITION OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION Pike Pharma GmbH (CH) 2012-03-14 EP disclosed
US-20110251182-A1 AGENTS AND METHODS FOR TREATING ISCHEMIC AND OTHER DISEASES NONO, INC. (CA) 2011-10-13 US disclosed
WO-2010128156-A1 2,1,3-BENZOXADIAZOL DERIVATIVES FOR THE INHIBITION OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION PIKE PHARMA GMBH (CH) 2010-11-11 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 (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-20110251182-A1 AGENTS AND METHODS FOR TREATING ISCHEMIC AND OTHER DISEASES TRPM7, TRPM8, TRPM6 MEN1 2102/4885KMT2A 4330/4885MYC 3788/4885
US-20120122896-A1 2,1,3-BENZOXADIAZOL DERIVATIVES FOR THE INHIBITION OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION TENT4B, IRF3, MAVS MEN1 4597/4885KMT2A 1674/4885MYC 2235/4885
US-20140235619-A1 AGENTS AND METHODS FOR TREATING ISCHEMIC AND OTHER DISEASES TRPM7, TRPM8, TRPM6 MEN1 2102/4885KMT2A 4330/4885MYC 3788/4885

“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.