SCHEMBL4872967

SCHEMBL4872967

CCOC(=O)c1cc(C)nc(NC(=O)OCc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.49
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
KMT2A Q03164 4/20 0.47
MEN1 O00255 2/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
GBA1 P04062 1/20 0.47
POLB P06746 1/20 0.46
RAF1 P04049 1/20 0.46
BRAF P15056 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
GAA P10253 1/20 0.45
MAP3K5 Q99683 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
MGLL Q99685 1/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL25713483 0.80 TDP1 (0.64) SMN1; SMN2RAB9ANPC1KMT2ALMNA
SCHEMBL7165686 0.80 RAB9A (0.57) NAMPTSMN1; SMN2RAB9ANPC1KMT2A
SCHEMBL3937264 0.78 LMNA (0.53) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL20937443 0.78 LMNA (0.48) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL30276208 0.78 LMNA (0.48) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL20389370 0.77 NAMPT (0.76) NAMPTSMN1; SMN2RAB9ANPC1KMT2A
SCHEMBL12852739 0.75 MEN1 (0.51) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL13327790 0.74 POLB (0.55) SMN1; SMN2RAB9ANPC1POLBMGLL
SCHEMBL18916793 0.74 JMJD6 (0.47) NAMPTSMN1; SMN2RAB9ANPC1KMT2A
SCHEMBL8726462 0.73 NAMPT (0.70) NAMPTSMN1; SMN2RAB9ANPC1KMT2A

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-20230346764-A1 Methods and Compositions for Treating Pruritus, Xerosis, and Associated Disease Using CCR3-Inhibitors ALKAHEST, INC. 2023-11-02 US disclosed
US-20080132477-A1 Macrocyclic Compounds Useful as Bace Inhibitors NOVARTIS AG (CH) 2008-06-05 US disclosed
EP-1851208-A1 MACROCYCLIC COMPOUNDS USEFUL AS BACE INHIBITORS Novartis AG (CH) 2007-11-07 EP disclosed
WO-2006074950-A1 MACROCYCLIC COMPOUNDS USEFUL AS BACE INHIBITORS NOVARTIS AG (CH) 2006-07-20 WO 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 (2 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-20230346764-A1 Methods and Compositions for Treating Pruritus, Xerosis, and Associated Disease Using CCR3-Inhibitors CCR3, CCR1, CCR4 NAMPT 3447/4885SMN1; SMN2 3606/4885RAB9A 1601/4885
US-20080132477-A1 Macrocyclic Compounds Useful as Bace Inhibitors BACE1, BACE2, APP NAMPT 1022/4885SMN1; SMN2 1117/4885RAB9A 2224/4885

“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.