SCHEMBL4356096

SCHEMBL4356096

CN(C)C1(C(NC(=O)c2ccc(F)c3ncccc23)c2ccccc2)CCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SLC6A9 P48067 4/20 0.41
ADAMTS5 Q9UNA0 2/20 0.35
PDE4A P27815 2/20 0.34
MAPK8 P45983 1/20 0.34
KCNH2 Q12809 1/20 0.34
TMEM97 Q5BJF2 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
KDM6B O15054 1/20 0.34
KDM6A O15550 1/20 0.34
TET3 O43151 1/20 0.34
KDM4A O75164 1/20 0.34
KDM4B O94953 1/20 0.34
KDM5C P41229 1/20 0.34
KDM4D Q6B0I6 1/20 0.34
TET2 Q6N021 1/20 0.34
ALKBH5 Q6P6C2 1/20 0.34

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
SCHEMBL4355261 0.88 CXCR5 (0.44) SLC6A9CXCR5SCN9ATACR3
SCHEMBL4367407 0.83 NSD2 (0.48) KDM4ESLC6A9TACR3
SCHEMBL4365704 0.82 SLC6A9 (0.41) KDM4EL3MBTL1RAB9ASLC6A9KDM4A
SCHEMBL4352703 0.81 PREP (0.49) SLC6A9TACR3
SCHEMBL3240639 0.80 SLC6A9 (0.38) SLC6A9
SCHEMBL8236886 0.80 P2RX7 (0.45) KDM4ESLC6A9MAPK8
SCHEMBL4182935 0.80 SLC6A9 (0.61) L3MBTL1NPC1RAB9ASLC6A9
SCHEMBL4356991 0.79 SCN9A (0.49) SLC6A9SCN9ATACR3
SCHEMBL4355380 0.79 SLC6A9 (0.38) RAB9ASLC6A9TACR3
SCHEMBL4359374 0.78 SLC6A9 (0.41) NPC1RAB9ASLC6A9SCN9ATACR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090286828-A1 2-AMINO-1-PHENYLETHYLCARBOXAMIDE DERIVATIVES GLAXO GROUP LIMITED (GB) 2009-11-19 US disclosed
US-20090286828-A1 2-AMINO-1-PHENYLETHYLCARBOXAMIDE DERIVATIVES GLAXO GROUP LIMITED (GB) 2009-11-19 US disclosed
US-20090286828-A1 2-AMINO-1-PHENYLETHYLCARBOXAMIDE DERIVATIVES GLAXO GROUP LIMITED (GB) 2009-11-19 US disclosed
WO-2006067430-A1 2-AMINO-1-PHENYLETHYLCARBOXAMIDE DERIVATIVES GLAXO GROUP LIMITED (GB) 2006-06-29 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-20090286828-A1 2-AMINO-1-PHENYLETHYLCARBOXAMIDE DERIVATIVES PNMT, SLC18A2, COMT KDM4E 453/4885L3MBTL1 2807/4885NPC1 287/4885

“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.