SCHEMBL7056650

SCHEMBL7056650

COCCN(CC(=O)O)c1cccc(C#N)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 1/20 0.45
KCNA5 P22460 1/20 0.45
MAOB P27338 1/20 0.41
FFAR1 O14842 2/20 0.40
GFER P55789 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
GSK3B P49841 2/20 0.40
MCHR1 Q99705 1/20 0.38
MAPK1 P28482 1/20 0.38
CLK1 P49759 1/20 0.38
MEP1A Q16819 1/20 0.37
MEP1B Q16820 1/20 0.37
GPR139 Q6DWJ6 1/20 0.37
OXTR P30559 1/20 0.37
AVPR1A P37288 1/20 0.37
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
KMT2A Q03164 1/20 0.36
SCN9A Q15858 1/20 0.36

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
SCHEMBL6982499 0.85 KCNN4 (0.54) KCNN4KCNA5MAOBFFAR1GFER
SCHEMBL3830265 0.82 KCNN4 (0.47) KCNN4KCNA5MAOBFFAR1GFER
SCHEMBL3345002 0.80 MAPK1 (0.50) KCNA5MAPK1MEN1KMT2A
SCHEMBL6982511 0.77 CRHBP (0.52) KCNN4KCNA5MAOBFFAR1FFAR4
SCHEMBL8106455 0.77 KCNN4 (0.43) KCNN4KCNA5MAOBFFAR1GFER
SCHEMBL7057421 0.76 FFAR1 (0.47) KCNN4KCNA5MAOBFFAR1FFAR4
SCHEMBL6476823 0.76 KCNA5 (0.46) KCNN4KCNA5GSK3BCLK1MEN1
SCHEMBL8117060 0.76 FFAR1 (0.42) KCNN4KCNA5MAOBFFAR1FFAR4
SCHEMBL8120082 0.76 FFAR1 (0.45) KCNN4KCNA5MAOBFFAR1GFER
SCHEMBL7357492 0.75 FFAR1 (0.47) KCNN4KCNA5MAOBFFAR1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030166694-A1 Glycinamides MERCK PATENT GMBH (DE) 2003-09-04 US 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-20030166694-A1 Glycinamides F11, SERPINC1, F13A1 KCNN4 4233/4885KCNA5 3355/4885MAOB 1287/4885

“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.