SCHEMBL172003

SCHEMBL172003

NC(=O)N1CCN(c2ccccc2)C1=S

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MEN1 O00255 3/20 0.46
SIGMAR1 Q99720 3/20 0.41
MAPT P10636 4/20 0.39
KDM4E B2RXH2 2/20 0.39
LMNA P02545 2/20 0.39
GAA P10253 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.38
HPGD P15428 2/20 0.38
ALOX15 P16050 2/20 0.38
HTT P42858 2/20 0.38
HSD17B10 Q99714 2/20 0.38
PTPN7 P35236 1/20 0.38
DUSP3 P51452 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
USP2 O75604 1/20 0.38

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
SCHEMBL5585348 0.81 MEN1 (0.62) KMT2ANPC1RAB9AMEN1SIGMAR1
SCHEMBL14045091 0.79 KMT2A (0.42) KMT2ANPC1RAB9AMEN1SIGMAR1
SCHEMBL3257577 0.77 SIGMAR1 (0.58) KMT2ANPC1RAB9AMEN1SIGMAR1
SCHEMBL10202145 0.75 NPC1 (0.39) KMT2ANPC1RAB9AMEN1KDM4E
SCHEMBL10172494 0.75 KMT2A (0.42) KMT2ANPC1RAB9AMEN1MAPT
SCHEMBL14019891 0.75 GAA (0.40) KMT2ANPC1RAB9AMEN1KDM4E
SCHEMBL13927746 0.72 NPC1 (0.60) KMT2ANPC1RAB9AMEN1SIGMAR1
SCHEMBL10288969 0.71 NAMPT (0.38) KMT2ANPC1RAB9AMEN1MAPT
SCHEMBL13917942 0.69 ATM (0.49) KMT2ANPC1RAB9AMEN1SIGMAR1
SCHEMBL10223619 0.68 KMT2A (0.48) KMT2ANPC1RAB9AMEN1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 US claimed
EP-2426108-B1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC (CA) 2016-08-10 EP disclosed
WO-2013044361-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2013-04-04 WO disclosed
EP-2426108-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors MethylGene Inc. (CA) 2012-03-07 EP disclosed
WO-2011127567-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2011-10-20 WO disclosed
WO-2009026717-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2009-03-05 WO disclosed
WO-2009026720-A1 PROCESSES AND INTERMEDIATES FOR PREPARING FUSED HETEROCYCLIC KINASE INHIBITORS METHYLGENE INC. (CA) 2009-03-05 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-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling HGF, MET, FLT1 KMT2A 3391/4885NPC1 1129/4885RAB9A 2065/4885

“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.