SCHEMBL7213783

SCHEMBL7213783

CC(=O)SCCN(CCC1CCCCC1)C(=O)NCCN1CC=CCC1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
SIGMAR1 Q99720 2/20 0.31
NPC1 O15118 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
SCHEMBL7214034 0.87 NPC1 (0.41) HDAC1HDAC6SIGMAR1NPC1
SCHEMBL7214714 0.87 NPC1 (0.41) HDAC1HDAC6SIGMAR1NPC1
SCHEMBL7214057 0.87 NPC1 (0.41) HDAC1HDAC6SIGMAR1NPC1
SCHEMBL7214420 0.86 HDAC1 (0.32) HDAC1HDAC6SIGMAR1
Hydrochloric Acid SCHEMBL7220424 0.86 NPC1 (0.41) HDAC1HDAC6SIGMAR1NPC1
SCHEMBL7510265 0.85 SIGMAR1 (0.42) HDAC1HDAC6SIGMAR1NPC1
SCHEMBL7214121 0.84 NPC1 (0.34) HDAC1HDAC6SIGMAR1NPC1
SCHEMBL7220913 0.84 HTT (0.38) HDAC1HDAC6SIGMAR1NPC1
SCHEMBL7213843 0.82 NPC1 (0.33) HDAC1HDAC6SIGMAR1NPC1
Hydrochloric Acid SCHEMBL7216056 0.82 KDM1A (0.33) HDAC1HDAC6SIGMAR1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6534499-B2 For therapy of autoimmune disease SANTEN PHARMACEUTICAL CO., LTD. (JP) 2003-03-18 US claimed
US-20020077357-A1 N-substituted-N'-substituted urea derivatives and the use thereof as TNF-alpha production inhibitory agents SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-06-20 US claimed
EP-1172359-A1 N-SUBSTITUTED-N'-SUBSTITUTED UREA DERIVATIVE AND USE THEREOF AS TNF-$g(a) PRODUCTION INHIBITOR SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-01-16 EP claimed
US-6534499-B2 For therapy of autoimmune disease SANTEN PHARMACEUTICAL CO., LTD. (JP) 2003-03-18 US disclosed
US-20020077357-A1 N-substituted-N'-substituted urea derivatives and the use thereof as TNF-alpha production inhibitory agents SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-06-20 US disclosed
EP-1172359-A1 N-SUBSTITUTED-N'-SUBSTITUTED UREA DERIVATIVE AND USE THEREOF AS TNF-$g(a) PRODUCTION INHIBITOR SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-01-16 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-20020077357-A1 N-substituted-N'-substituted urea derivatives and the use thereof as TNF-alpha production inhibitory agents TNF, NFKBIA, CHUK HDAC1 2415/4885HDAC6 1605/4885SIGMAR1 526/4885

“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.