SCHEMBL1157562

SCHEMBL1157562

COc1ccc(C=NNC(N)=NO)cc1Br

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.55
KDM4E B2RXH2 5/20 0.53
ALDH1A1 P00352 5/20 0.53
KMT2A Q03164 3/20 0.53
GAA P10253 2/20 0.53
MEN1 O00255 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
GFER P55789 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
USP2 O75604 1/20 0.51
MMP9 P14780 1/20 0.50
LMNA P02545 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
POLB P06746 1/20 0.48
HPGD P15428 3/20 0.47

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
SCHEMBL13673576 0.85 SMN1; SMN2 (0.60) MAPTKDM4EALDH1A1KMT2AGAA
SCHEMBL23996059 0.85 SMN1; SMN2 (0.60) MAPTKDM4EALDH1A1KMT2AGAA
SCHEMBL7747519 0.85 MAPT (0.56) MAPTKDM4EALDH1A1KMT2AGAA
SCHEMBL7747517 0.85 MAPT (0.56) MAPTKDM4EALDH1A1KMT2AGAA
SCHEMBL13673610 0.84 KDM4E (0.50) MAPTKDM4EALDH1A1KMT2AMEN1
Hydrochloric Acid SCHEMBL915893 0.84 MAPT (0.55) MAPTKDM4EALDH1A1KMT2AGAA
Hydrochloric Acid SCHEMBL915892 0.84 MAPT (0.55) MAPTKDM4EALDH1A1KMT2AGAA
SCHEMBL15365567 0.81 KDM4E (0.72) MAPTKDM4EALDH1A1KMT2AGAA
SCHEMBL1157558 0.80 MAPT (0.56) MAPTKDM4EALDH1A1KMT2AGAA
SCHEMBL1157559 0.80 MAPT (0.56) MAPTKDM4EALDH1A1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8410174-B2 Method for treating arthritis ANAMAR AB (SE) 2013-04-02 US disclosed
US-8309609-B2 Use of benzylideneaminoguanidines and hydroxyguanidines as melanocortin receptor ligands ANAMAR AB (SE) 2012-11-13 US disclosed
US-20120190751-A1 COMPOUNDS FOR TREATMENTS OF INFLAMMATION ANA-MAR AB (SE) 2012-07-26 US disclosed
EP-2470270-A1 COMPOUNDS FOR TREATMENT OF INFLAMMATION AnaMar AB (SE) 2012-07-04 EP disclosed
WO-2011012868-A1 COMPOUNDS FOR TREATMENT OF INFLAMMATION ANAMAR AB (SE) 2011-02-03 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-20120190751-A1 COMPOUNDS FOR TREATMENTS OF INFLAMMATION IL6, IL1B, TNF MAPT 3564/4885KDM4E 597/4885ALDH1A1 576/4885

“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.