SCHEMBL6891136

SCHEMBL6891136

CC(=O)SCCN(CCC1CCCCC1)C(=O)NC1(C(=O)N2CCN(C)CC2)CCCC1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSB P07858 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
CTSL P07711 1/20 0.32
FAAH O00519 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
SIGMAR1 Q99720 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL6895838 0.97 SIGMAR1 (0.31) LMNASIGMAR1KDM4EALDH1A1
SCHEMBL6899147 0.87 CTSB (0.34) CTSBLMNATSHRCTSLFAAH
SCHEMBL6898778 0.84 ALDH1A1 (0.33) CTSBLMNATSHRCTSLSIGMAR1
SCHEMBL6898252 0.80 HSD11B1 (0.36) CTSBLMNASIGMAR1KDM4EALDH1A1
SCHEMBL6895895 0.79 CNR1 (0.34) LMNASIGMAR1KDM4EALDH1A1
SCHEMBL6897959 0.78 TP53 (0.36) LMNASIGMAR1KDM4EALDH1A1
SCHEMBL6898851 0.78 TP53 (0.36) LMNASIGMAR1KDM4EALDH1A1
SCHEMBL6897826 0.78 TP53 (0.36) LMNASIGMAR1KDM4EALDH1A1
SCHEMBL7664089 0.78 TP53 (0.35) SIGMAR1KDM4EALDH1A1
SCHEMBL6897336 0.77 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 4 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
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 CTSB 1387/4885LMNA 4204/4885TSHR 580/4885

“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.