SCHEMBL10246413

SCHEMBL10246413

COC(=O)c1cc(N)cc(NC(=O)c2ccc(Cl)cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.59
PTPN11 Q06124 1/20 0.56
RAB9A P51151 6/20 0.54
NPC1 O15118 5/20 0.54
NPSR1 Q6W5P4 2/20 0.54
MAPT P10636 7/20 0.50
KMT2A Q03164 7/20 0.50
MEN1 O00255 5/20 0.50
ALDH1A1 P00352 3/20 0.50
LMNA P02545 3/20 0.50
GAA P10253 1/20 0.50
MAPK1 P28482 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
HPGD P15428 2/20 0.49
PRMT1 Q99873 1/20 0.49
XBP1 P17861 1/20 0.49
HTT P42858 1/20 0.49
ATM Q13315 2/20 0.48
CTDSP1 Q9GZU7 1/20 0.47
L3MBTL1 Q9Y468 1/20 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
SCHEMBL2722651 0.87 NPC1 (0.53) KDM4EPTPN11RAB9ANPC1MAPT
SCHEMBL23782413 0.86 RAB9A (0.68) KDM4EPTPN11RAB9ANPC1MAPT
SCHEMBL31454342 0.86 RAB9A (0.68) KDM4EPTPN11RAB9ANPC1MAPT
SCHEMBL10078187 0.84 KDM4E (0.68) KDM4EPTPN11RAB9ANPC1MAPT
SCHEMBL21242859 0.81 NPC1 (0.71) KDM4ERAB9ANPC1MAPTKMT2A
SCHEMBL26482714 0.80 PTPN11 (0.71) KDM4EPTPN11RAB9ANPC1KMT2A
SCHEMBL1815384 0.80 RAB9A (0.80) RAB9ANPC1NPSR1MAPTKMT2A
SCHEMBL10246416 0.79 MEN1 (0.65) KDM4EPTPN11RAB9ANPC1NPSR1
SCHEMBL230254 0.77 MAPT (0.49) KDM4ERAB9ANPC1NPSR1MAPT
SCHEMBL177003 0.77 ALDH1A1 (0.51) KDM4ENPSR1MAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130261130-A1 NEUROTRYPSIN INHIBITORS NEUROTUNE AG (CH) 2013-10-03 US disclosed
US-20130261130-A1 NEUROTRYPSIN INHIBITORS NEUROTUNE AG (CH) 2013-10-03 US disclosed
WO-2012059442-A2 NEUROTRYPSIN INHIBITORS NEUROTUNE AG (CH) 2012-05-10 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-20130261130-A1 NEUROTRYPSIN INHIBITORS MTPN, CHRNA7, CHRNA10 KDM4E 3685/4885PTPN11 931/4885RAB9A 2408/4885

“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.