SCHEMBL4666506

SCHEMBL4666506

CCc1nc2c(O)c(CN(C)C)c(C(=O)N(C)C)cc2n1C

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 3/20 0.33
ALDH1A1 P00352 3/20 0.31
GAA P10253 2/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
ERAP1 Q9NZ08 2/20 0.30
KDM4E B2RXH2 1/20 0.30
GLA P06280 1/20 0.30
HPGD P15428 1/20 0.30
CASP1 P29466 1/20 0.30
HTT P42858 1/20 0.30
CASP7 P55210 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
PDK1 Q15118 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
RORC P51449 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
SCHEMBL4574787 0.85 MEN1 (0.33) ALDH1A1GAAMEN1KMT2ALMNA
SCHEMBL4664854 0.80 KMT2A (0.34) ALDH1A1GAAMEN1KMT2AHPGD
SCHEMBL4664676 0.78 CXCR2 (0.34) ALDH1A1KDM4E
SCHEMBL4662894 0.74 ACSS2 (0.34) MAP4K1ALDH1A1PDK1
SCHEMBL5116642 0.73 GAA (0.43) ALDH1A1GAAMEN1KMT2ALMNA
SCHEMBL4737338 0.71 KDM4E (0.36) ALDH1A1GAAMEN1KMT2AKDM4E
SCHEMBL1944197 0.70 ALDH3A1 (0.41) ALDH1A1GAAKMT2ALMNAKDM4E
SCHEMBL4965054 0.69 HCRTR1 (0.32)
SCHEMBL4963790 0.67
SCHEMBL4963794 0.67

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 MAP4K1 1953/4885ALDH1A1 293/4885GAA 418/4885
US-20080113963-A1 Cyclic benzimidazoles VIP, GIPR, SI MAP4K1 1837/4885ALDH1A1 2588/4885GAA 65/4885

“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.