SCHEMBL6784069

SCHEMBL6784069

CC(C)C(=O)NCC(C)c1ccc(-c2ccc(CCNS(C)(=O)=O)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 11/20 0.68
KMT2A Q03164 2/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
RAB9A P51151 1/20 0.39
ADRB3 P13945 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA9 Q16790 1/20 0.39
GRIA1 P42261 1/20 0.38
GRIA2 P42262 1/20 0.38
GRIA3 P42263 1/20 0.38
MEN1 O00255 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
SCHEMBL5877621 0.82 GRIA4 (0.70) GRIA4KMT2ACYP2D6CYP2C9CYP2C19
Mibampator SCHEMBL6660037 0.81 GRIA4 (1.00) GRIA4GRIA1GRIA2GRIA3
Mibampator SCHEMBL3074747 0.81 GRIA4 (1.00) GRIA4GRIA1GRIA2GRIA3
Mibampator SCHEMBL3045499 0.81 GRIA4 (1.00) GRIA4GRIA1GRIA2GRIA3
SCHEMBL12076289 0.79 GRIA4 (0.70) GRIA4KMT2ACA12CA1CA2
SCHEMBL6660039 0.78 GRIA4 (0.72) GRIA4KMT2AGRIA1GRIA2GRIA3
SCHEMBL3074752 0.78 GRIA4 (0.72) GRIA4KMT2AGRIA1GRIA2GRIA3
SCHEMBL3045502 0.78 GRIA4 (0.72) GRIA4KMT2AGRIA1GRIA2GRIA3
SCHEMBL8319309 0.77 GRIA4 (0.67) GRIA4KMT2AGRIA1GRIA2GRIA3
SCHEMBL6563305 0.77 GRIA4 (0.92) GRIA4GRIA1GRIA2GRIA3

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-20040097499-A1 Amide, carbamate, and urea derivatives ARNOLD MACKLIN BRIAN (US) 2004-05-20 US disclosed
US-6617351-B1 Amide, carbamate, and urea derivatives ELI LILLY AND COMPANY 2003-09-09 US disclosed
EP-0976744-A1 Amide, carbamate, and urea derivatives having glutamate receptor function potentiating activity ELI LILLY AND COMPANY (US) 2000-02-02 EP 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-20040097499-A1 Amide, carbamate, and urea derivatives GRIN2A, GLUL, GRIK5 GRIA4 16/4885KMT2A 587/4885CYP2D6 3900/4885

“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.