SCHEMBL6895895

SCHEMBL6895895

CC(=O)SCCN(CCC1CCCCC1)C(=O)NC(C)(C)C(=O)N1CCN(C)CC1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.34
CNR2 P34972 5/20 0.34
SIGMAR1 Q99720 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD11B1 P28845 1/20 0.31
LMNA P02545 1/20 0.31
CHRM3 P20309 2/20 0.31
HDAC3 O15379 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
CASR P41180 1/20 0.31
FKBP1A P62942 2/20 0.30
TP53 P04637 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
SCHEMBL6898335 0.86 CNR1 (0.36) CNR1CNR2SIGMAR1KDM4EALDH1A1
SCHEMBL6898252 0.82 HSD11B1 (0.36) SIGMAR1KDM4EALDH1A1HSD11B1LMNA
SCHEMBL6897959 0.81 TP53 (0.36) SIGMAR1KDM4EALDH1A1HSD11B1LMNA
SCHEMBL6897826 0.81 TP53 (0.36) SIGMAR1KDM4EALDH1A1HSD11B1LMNA
SCHEMBL6898851 0.81 TP53 (0.36) SIGMAR1KDM4EALDH1A1HSD11B1LMNA
SCHEMBL7664089 0.80 TP53 (0.35) SIGMAR1KDM4EALDH1A1CHRM3TP53
SCHEMBL6895838 0.80 SIGMAR1 (0.31) SIGMAR1KDM4EALDH1A1HSD11B1LMNA
SCHEMBL6897336 0.80 TP53 (0.34) SIGMAR1CHRM3HDAC3HDAC8TP53
SCHEMBL6891136 0.79 CTSB (0.32) SIGMAR1KDM4EALDH1A1LMNA
SCHEMBL7510265 0.79 SIGMAR1 (0.42) CNR1SIGMAR1ALDH1A1HSD11B1HDAC8

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
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 CNR1 207/4885CNR2 383/4885SIGMAR1 26/4885

“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.