SCHEMBL6777902

SCHEMBL6777902

CC(N)C(S)CCS(=O)(=O)O

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ENPEP Q07075 14/20 0.41
PTGS1 P23219 1/20 0.37
PDE4A P27815 1/20 0.37
LMNA P02545 1/20 0.37
SLC6A6 P31641 1/20 0.37
CYP2C19 P33261 1/20 0.37
BLM P54132 1/20 0.37
TP53 P04637 1/20 0.36
S1PR2 O95136 1/20 0.35
S1PR1 P21453 1/20 0.35
S1PR3 Q99500 1/20 0.35
APP P05067 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
SCHEMBL28788386 0.82 PTGS1 (0.40) ENPEPPTGS1PDE4ALMNASLC6A6
SCHEMBL4252124 0.78 ENPEP (0.48) ENPEPPTGS1PDE4ALMNASLC6A6
SCHEMBL3626027 0.77 ENPEP (0.43) ENPEPLMNASLC6A6CYP2C19BLM
SCHEMBL11565955 0.77
SCHEMBL21623887 0.77
SCHEMBL356494 0.77
SCHEMBL4244376 0.76 ENPEP (0.43) ENPEPTP53
SCHEMBL6772116 0.76 TRPV1 (0.50) ENPEPPTGS1PDE4ALMNASLC6A6
SCHEMBL5148884 0.75 TP53 (0.50) ENPEPPTGS1PDE4ALMNASLC6A6
Water SCHEMBL28825835 0.75 TP53 (0.50) ENPEPPTGS1PDE4ALMNASLC6A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040197293-A1 Anionic polyurethanes with elastic property L'OREAL S.A. (FR) 2004-10-07 US claimed
US-20040197293-A1 Anionic polyurethanes with elastic property L'OREAL S.A. (FR) 2004-10-07 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-20040197293-A1 Anionic polyurethanes with elastic property PUF60, PHOSPHO1, PLA2G2C ENPEP 3516/4885PTGS1 106/4885PDE4A 1523/4885

“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.