SCHEMBL6784440

SCHEMBL6784440

CCCNC(=O)NCC(C)c1ccc(-c2ccsc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 3/20 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
OPRM1 P35372 2/20 0.38
OPRD1 P41143 2/20 0.38
OPRK1 P41145 2/20 0.38
EPHX1 P07099 1/20 0.38
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP17A1 P05093 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
ACACB O00763 1/20 0.36
CYP1A2 P05177 1/20 0.35
GSK3B P49841 1/20 0.35
SLC6A2 P23975 3/20 0.35
SLC6A4 P31645 3/20 0.35

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
SCHEMBL6788018 0.86 GRIA4 (0.60) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL7209225 0.85 GRIA4 (0.59) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6787350 0.83 GRIA4 (0.64) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL4584209 0.83 GRIA4 (0.63) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6783719 0.83 GRIA4 (0.63) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6793790 0.82 GRIA4 (0.53) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6790065 0.82 GRIA4 (0.61) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6789814 0.81 GRIA4 (0.60) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6784120 0.81 GRIA4 (0.54) GRIA4CTSLCTSBCTSSCTSK
SCHEMBL6789706 0.80 GRIA4 (0.56) 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 1 patent. 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

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.