SCHEMBL4778463

SCHEMBL4778463

CN1C(=O)N(CO)C(=O)C1CO

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.32
ADRA2C P18825 1/20 0.32
CAPN1 P07384 1/20 0.32
BRD4 O60885 1/20 0.31
MAPK1 P28482 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
SCHEMBL503017 0.78 KDM4E (0.38) L3MBTL1ADRA2CCAPN1BRD4MAPK1
SCHEMBL25937459 0.77 CAPN1 (0.47) L3MBTL1ADRA2CCAPN1BRD4MAPK1
SCHEMBL9634672 0.77 L3MBTL1 (0.38) L3MBTL1
SCHEMBL11464542 0.77 ADRA2C (0.33) L3MBTL1ADRA2CMAPK1
SCHEMBL25937418 0.70 CAPN1 (0.41) L3MBTL1CAPN1BRD4
Dioxane SCHEMBL9486523 0.69 KDM4E (0.36) L3MBTL1BRD4
SCHEMBL11999052 0.67 ADRA2C (0.48) L3MBTL1ADRA2CBRD4MAPK1
SCHEMBL10501254 0.67 KDM4E (0.35) L3MBTL1
SCHEMBL9193310 0.66 CRBN (0.33) L3MBTL1
SCHEMBL25404748 0.65 F2 (0.41) HDAC6ADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080131420-A1 METHODS AND COMPOSITIONS FOR TREATING MUCOSAL INFLAMMATION ACCENTIA, INC. (US) 2008-06-05 US disclosed
WO-2008008494-A2 METHODS AND COMPOSITIONS FOR TREATING MUCOSAL INFLAMMATION ACCENTIA BIOPHARMACEUTICALS, INC. (US) 2008-01-17 WO disclosed
EP-0744171-B1 DENTAL COMPOSITION FOR HYPERSENSITIVE DENTIN SUN MEDICAL CO LTD (JP) 2003-09-03 EP disclosed
EP-0721773-B1 Dental composition for relieving dentin hypersensitivity SUN MEDICAL CO LTD (JP) 2002-03-27 EP disclosed
US-5879663-A Dental composition for dentin hypersensitivity SUN MEDICAL CO., LTD. (JP) 1999-03-09 US disclosed
US-5766328-A Dental composition for relieving dentin hypersensitivity SUN MEDICAL CO., LTD. (JP) 1998-06-16 US disclosed
EP-0744171-A1 DENTAL COMPOSITION FOR HYPERSENSITIVE DENTIN SUN MEDICAL CO., LTD. (JP) 1996-11-27 EP disclosed
EP-0721773-A2 Dental composition for relieving dentin hypersensitivity SUN MEDICAL CO., LTD. (JP) 1996-07-17 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-20080131420-A1 METHODS AND COMPOSITIONS FOR TREATING MUCOSAL INFLAMMATION MMP8, MUC1, MPO HDAC6 190/4885L3MBTL1 4869/4885ADRA2C 3160/4885

“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.