SCHEMBL6789706

SCHEMBL6789706

CCN(CC)C(=O)NCC(C)c1ccc(-c2ccsc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 6/20 0.56
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
CYP17A1 P05093 2/20 0.39
ACACB O00763 2/20 0.39
P2RX3 P56373 1/20 0.36
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ABCC1 P33527 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
ADORA2A P29274 1/20 0.34
ADORA2B P29275 1/20 0.34
ADORA1 P30542 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
SCHEMBL6783013 0.87 GRIA4 (0.59) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6787350 0.83 GRIA4 (0.64) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6783719 0.83 GRIA4 (0.63) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL4584209 0.83 GRIA4 (0.63) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6790065 0.82 GRIA4 (0.61) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6789814 0.81 GRIA4 (0.60) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6788018 0.81 GRIA4 (0.60) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6784440 0.80 GRIA4 (0.56) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL7209225 0.80 GRIA4 (0.59) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6789847 0.80 GRIA4 (0.59) GRIA4CTSLCTSBCTSSCTSK

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 16/4885CTSL 2458/4885CTSB 1153/4885

“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.