SCHEMBL4355261

SCHEMBL4355261

CN(C)C1(C(NC(=O)c2ccc(F)c3ccccc23)c2ccccc2)CCCC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CXCR5 P32302 1/20 0.44
SCN9A Q15858 3/20 0.43
MAPK10 P53779 1/20 0.39
TACR3 P29371 2/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
SLC6A9 P48067 7/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CHRM2 P08172 2/20 0.35
LMNA P02545 1/20 0.34
HPGD P15428 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
SCHEMBL4356991 0.88 SCN9A (0.49) SCN9ATACR3SLC6A9KMT2ALMNA
SCHEMBL4356096 0.88 KDM4E (0.41) CXCR5SCN9ATACR3SLC6A9
SCHEMBL4359374 0.87 SLC6A9 (0.41) SCN9ATACR3SLC6A9MEN1KMT2A
SCHEMBL3240639 0.87 SLC6A9 (0.38) SLC6A9MEN1KMT2ALMNAHPGD
SCHEMBL4357362 0.85 PLK1 (0.50) SCN9ATACR3SLC6A9MEN1KMT2A
SCHEMBL4358082 0.84 SLC22A12 (0.40) SCN9AMAPK10TACR3SLC6A9LMNA
SCHEMBL3238085 0.83 TAS1R3 (0.41) SLC6A9MEN1KMT2A
SCHEMBL3239804 0.82 SLC6A9 (0.47) SLC6A9MEN1KMT2A
SCHEMBL4361757 0.81 NCEH1 (0.40) TACR3SLC6A9MEN1KMT2ALMNA
SCHEMBL4352703 0.81 PREP (0.49) TACR3SLC6A9

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 CXCR5 4405/4885SCN9A 3102/4885MAPK10 3138/4885

“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.