SCHEMBL5162007

SCHEMBL5162007

O=C1c2cccc3c([N+](=O)[O-])ccc(c23)C(=O)N1c1cccnc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.68
MEN1 O00255 14/20 0.67
KMT2A Q03164 14/20 0.67
HTT P42858 7/20 0.67
MAPT P10636 7/20 0.67
POLB P06746 7/20 0.67
RAB9A P51151 5/20 0.67
CCR6 P51684 3/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
MAPK1 P28482 2/20 0.67
L3MBTL1 Q9Y468 2/20 0.67
TDP1 Q9NUW8 1/20 0.67
NPC1 O15118 7/20 0.63
NPSR1 Q6W5P4 6/20 0.63
S1PR4 O95977 3/20 0.63
S1PR1 P21453 3/20 0.63
HPGD P15428 1/20 0.63
XBP1 P17861 1/20 0.63
GAA P10253 2/20 0.60
HSD17B10 Q99714 1/20 0.60

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
SCHEMBL16213360 0.84 KMT2A (0.68) KDM4EMEN1KMT2AHTTMAPT
SCHEMBL16863007 0.81 KDM4E (1.00) KDM4EMEN1KMT2AHTTMAPT
SCHEMBL22668259 0.78 HTT (0.77) KDM4EHTTMAPTPOLBRAB9A
SCHEMBL8618712 0.77 MEN1 (0.73) KDM4EMEN1KMT2AHTTMAPT
SCHEMBL19450676 0.77 MEN1 (0.63) KDM4EMEN1KMT2AHTTMAPT
SCHEMBL16213338 0.77 MEN1 (0.76) KDM4EMEN1KMT2AHTTMAPT
SCHEMBL5529962 0.76 MAPT (0.68) KDM4EMEN1KMT2AHTTMAPT
SCHEMBL13401373 0.76 MEN1 (0.62) KDM4EMEN1KMT2AHTTMAPT
SCHEMBL11200203 0.76 MEN1 (0.62) KDM4EMEN1KMT2AHTTMAPT
SCHEMBL4235162 0.76 MEN1 (0.70) KDM4EMEN1KMT2AHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070123514-A1 Methods of modulating neurotrophin-mediated activity PAINCEPTOR PHARMA CORPORATION (CA) 2007-05-31 US claimed
WO-2007030939-A2 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PAINCEPTOR PHARMA CORPORATION (CA) 2007-03-22 WO claimed

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-20070123514-A1 Methods of modulating neurotrophin-mediated activity NGF, BDNF, NTRK2 KDM4E 4479/4885MEN1 3865/4885KMT2A 4267/4885

“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.