SCHEMBL4935524

SCHEMBL4935524

CC(C)(C)CNCCN1CCOC1=O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 5/20 0.39
MAPT P10636 3/20 0.38
GAA P10253 1/20 0.38
PIK3CD O00329 2/20 0.37
LMNA P02545 2/20 0.36
POLB P06746 3/20 0.36
GLA P06280 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
KMT2A Q03164 1/20 0.34
NQO2 P16083 1/20 0.34
IRAK1 P51617 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
IDO1 P14902 1/20 0.33
KCNH2 Q12809 1/20 0.33
NAAA Q02083 1/20 0.33

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
SCHEMBL17778035 0.81 KDM4E (0.43) KDM4EALDH1A1MAPTGAAPIK3CD
SCHEMBL6107954 0.80 KDM4E (0.42) KDM4EALDH1A1MAPTGAAPIK3CD
SCHEMBL25554624 0.79 KDM4E (0.41) KDM4EALDH1A1MAPTGAAPIK3CD
SCHEMBL12478506 0.78 KDM4E (0.45) KDM4EALDH1A1MAPTGAAPIK3CD
SCHEMBL15097937 0.78 KDM4E (0.45) KDM4EALDH1A1MAPTPIK3CDLMNA
SCHEMBL19233532 0.77 ACE2 (0.46) KDM4EALDH1A1MAPTGAAPIK3CD
SCHEMBL19767304 0.76 KDM4E (0.44) KDM4EALDH1A1MAPTPIK3CDLMNA
SCHEMBL11062023 0.75 PIK3CD (0.46) KDM4EPIK3CDNQO2NAAA
SCHEMBL23895932 0.74 KDM4E (0.45) KDM4EALDH1A1MAPTGAAPIK3CD
SCHEMBL17776657 0.73 PIK3CD (0.49) KDM4EALDH1A1MAPTGAAPIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312192-A1 Diaryl Urea Derivatives in the Treatment of Protein Kinase Dependent Diseases BOLD GUIDO 2008-12-18 US disclosed
EP-1689376-A2 DIARYL UREA DERIVATIVES IN THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES Novartis AG (CH) 2006-08-16 EP disclosed
WO-2005051366-A2 DIARYL UREA DERIVATIVES IN THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES NOVARTIS AG (CH) 2005-06-09 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 (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-20080312192-A1 Diaryl Urea Derivatives in the Treatment of Protein Kinase Dependent Diseases RET, PRKDC, PRKACA KDM4E 882/4885ALDH1A1 3290/4885MAPT 450/4885

“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.