SCHEMBL6808450

SCHEMBL6808450

CC(=O)NC(CC(C)C)C(=O)c1nnc(SCCN(C)C)o1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.38
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.32
TP53 P04637 1/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
UTS2R Q9UKP6 1/20 0.30
CTSK P43235 1/20 0.30

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
Hydrochloric Acid SCHEMBL6809021 0.99 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1TSHRHTTL3MBTL1
SCHEMBL6808872 0.85 TSHR (0.52) SMN1; SMN2ALDH1A1TSHRHTTL3MBTL1
SCHEMBL6809092 0.85 ALDH1A1 (0.38) ALDH1A1TSHRHTTL3MBTL1TP53
Hydrochloric Acid SCHEMBL6809032 0.84 TSHR (0.51) SMN1; SMN2ALDH1A1TSHRHTTL3MBTL1
SCHEMBL6807966 0.84 TSHR (0.36) SMN1; SMN2ALDH1A1TSHRHTTL3MBTL1
Hydrochloric Acid SCHEMBL6808628 0.84 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1TSHRHTTL3MBTL1
Hydrochloric Acid SCHEMBL6812948 0.84 SMN1; SMN2 (0.36) SMN1; SMN2ALDH1A1TSHRHTTL3MBTL1
SCHEMBL14597832 0.84 SMN1; SMN2 (0.39) SMN1; SMN2ALDH1A1TSHRLMNAMEN1
SCHEMBL6808023 0.81 CTSL (0.49) CTSK
Hydrochloric Acid SCHEMBL6809074 0.80 CTSL (0.49) SMN1; SMN2CTSK

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-20040204368-A1 Oxadiazole derivative compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2004-10-14 US claimed

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-20040204368-A1 Oxadiazole derivative compounds and drugs containing these compounds as the active ingredient ACIN1, CASP3, CASP7 SMN1; SMN2 1536/4885ALDH1A1 1531/4885TSHR 1975/4885

“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.