SCHEMBL6895838

SCHEMBL6895838

CC(=O)SCCN(CCC1CCCCC1)C(=O)NC1(C(=O)N2CCN(C)CC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD11B1 P28845 1/20 0.30
SLC5A1 P13866 1/20 0.30
SLC5A2 P31639 1/20 0.30
LMNA P02545 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
SCHEMBL6891136 0.97 CTSB (0.32) SIGMAR1KDM4EALDH1A1LMNA
SCHEMBL6898778 0.87 ALDH1A1 (0.33) SIGMAR1KDM4EALDH1A1HSD11B1SLC5A1
SCHEMBL6899147 0.84 CTSB (0.34) SIGMAR1KDM4EALDH1A1HSD11B1LMNA
SCHEMBL6898252 0.81 HSD11B1 (0.36) SIGMAR1KDM4EALDH1A1HSD11B1LMNA
SCHEMBL6895895 0.80 CNR1 (0.34) SIGMAR1KDM4EALDH1A1HSD11B1LMNA
SCHEMBL6897959 0.79 TP53 (0.36) SIGMAR1KDM4EALDH1A1HSD11B1LMNA
SCHEMBL6897826 0.79 TP53 (0.36) SIGMAR1KDM4EALDH1A1HSD11B1LMNA
SCHEMBL6898851 0.79 TP53 (0.36) SIGMAR1KDM4EALDH1A1HSD11B1LMNA
SCHEMBL7664089 0.78 TP53 (0.35) SIGMAR1KDM4EALDH1A1
SCHEMBL6897336 0.78 TP53 (0.34) SIGMAR1

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 SIGMAR1 26/4885KDM4E 2856/4885ALDH1A1 1309/4885

“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.