SCHEMBL6898124

SCHEMBL6898124

CC(=O)SCCN(CCC1CCCCC1)C(=O)NCC(=O)NCCO

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CASR P41180 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
EPHX1 P07099 1/20 0.31

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
SCHEMBL6893494 0.85 KDM5A (0.35) CASREPHX1
SCHEMBL6741613 0.82 SIGMAR1 (0.40) CASRSIGMAR1EPHX1
SCHEMBL6734367 0.81 PKM (0.37) CASRSIGMAR1EPHX1
SCHEMBL6898719 0.81 CASR (0.33) CASREPHX1
SCHEMBL7214057 0.80 NPC1 (0.41) SIGMAR1
SCHEMBL7214034 0.80 NPC1 (0.41) SIGMAR1
SCHEMBL7214714 0.80 NPC1 (0.41) SIGMAR1
Hydrochloric Acid SCHEMBL7220424 0.79 NPC1 (0.41) SIGMAR1
SCHEMBL7220076 0.78 ALDH1A1 (0.42) SIGMAR1EPHX1
SCHEMBL7214804 0.78 ALDH1A1 (0.42) SIGMAR1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6730784-B2 AS THERAPEUTIC AGENTS FOR AUTOIMMUNE DISEASES SUCH AS RHEUMATOID ARTHRITIS SANTEN PHARMACEUTICAL CO., LTD. (JP) 2004-05-04 US disclosed
US-20020198376-A1 Novel urea derivatives SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-12-26 US disclosed
US-6492370-B1 Urea derivatives and pharmaceutical compositions thereof SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-12-10 US disclosed
CN-1299344-A Novel urea derivatives SANTEN PHARCEUMATICAL CO LTD (JP) 2001-06-13 CN disclosed
EP-1072591-A1 NOVEL UREA DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2001-01-31 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-20020198376-A1 Novel urea derivatives TNF, CTH, CFH CASR 2206/4885SIGMAR1 26/4885EPHX1 984/4885

“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.