SCHEMBL4664632

SCHEMBL4664632

CCOC(=O)c1cc2c(nc(C)n2C)c2c1CCC(c1ccccc1)O2

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.38
KDM4E B2RXH2 5/20 0.38
HPGD P15428 2/20 0.38
GAA P10253 2/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
MAPT P10636 1/20 0.35
ALOX12 P18054 1/20 0.35
GRK6 P43250 1/20 0.35
ELANE P08246 1/20 0.35
ACHE P22303 2/20 0.35
LMNA P02545 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
ATP4A P20648 1/20 0.34
ATP4B P51164 1/20 0.34
SLC8A1 P32418 1/20 0.34
TSHR P16473 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL4663178 0.88 DHODH (0.36) MEN1KMT2AMAPTATP4AATP4B
SCHEMBL6020045 0.88 DHODH (0.36) MEN1KMT2AMAPTATP4AATP4B
SCHEMBL6019450 0.88 DHODH (0.36) MEN1KMT2AMAPTATP4AATP4B
SCHEMBL4666543 0.87 RAB9A (0.35) ATP4AATP4BSLC8A1
SCHEMBL5506543 0.87 RAB9A (0.35) ATP4AATP4BSLC8A1
SCHEMBL5506550 0.87 RAB9A (0.35) ATP4AATP4BSLC8A1
SCHEMBL4662902 0.85 RIPK1 (0.36) KDM4EATP4AATP4BSLC8A1
SCHEMBL4664616 0.85 RIPK1 (0.36) KDM4EATP4AATP4BSLC8A1
SCHEMBL4664869 0.85 MEN1 (0.39) MEN1KMT2ASLC8A1
SCHEMBL5116463 0.85 RAB9A (0.36) ATP4AATP4BSLC8A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080113963-A1 Cyclic benzimidazoles ALTANA PHARMA AG (DE) 2008-05-15 US disclosed
US-7307084-B2 Cyclic benzimidazoles ALTANA PHARMA AG (DE) 2007-12-11 US disclosed
US-20060194968-A1 Cyclic benizimidazoles ALTANA PHARMA AG (DE) 2006-08-31 US disclosed
EP-1613626-A1 CYCLIC BENZIMIDAZOLES ALTANA Pharma AG (DE) 2006-01-11 EP disclosed
WO-2004087701-A1 CYCLIC BENZIMIDAZOLES ALTANA PHARMA AG (DE) 2004-10-14 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-20060194968-A1 Cyclic benizimidazoles VIP, SI, GIPR ALDH1A1 293/4885KDM4E 1927/4885HPGD 548/4885
US-20080113963-A1 Cyclic benzimidazoles VIP, GIPR, SI ALDH1A1 2588/4885KDM4E 3472/4885HPGD 810/4885

“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.