SCHEMBL4299785

SCHEMBL4299785

CCOCc1nc2c(N)nc(C)c(C)c2n1NCCCNC(=O)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.37
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TSHR P16473 2/20 0.35
CHRM1 P11229 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TLR7 Q9NYK1 1/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
MEN1 O00255 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
SCHEMBL6778648 0.88 TP53 (0.38) NAAAKMT2ACHRM1SMN1; SMN2TLR7
SCHEMBL13996157 0.86 MEN1 (0.41) NAAAKMT2ATSHRCHRM1SMN1; SMN2
Hydrochloric Acid SCHEMBL5027827 0.86 MEN1 (0.41) NAAAKMT2ATSHRCHRM1SMN1; SMN2
SCHEMBL13663024 0.84 TLR7 (0.37) KMT2ATSHRTLR7MEN1
SCHEMBL5410400 0.83 TLR7 (0.50) TLR7
SCHEMBL4302557 0.83 TLR7 (0.34) TSHRTLR7
SCHEMBL6775573 0.83 TLR7 (0.39) KMT2ATSHRTLR7KDM4EALDH1A1
SCHEMBL4299127 0.78 TLR7 (0.40) TLR7
SCHEMBL4296141 0.77 TLR7 (0.34) TLR7
SCHEMBL13663012 0.77 TLR7 (0.36) TLR7

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-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS COLEY PHARMACEUTICAL GROUP, INC. 2009-10-29 US disclosed
US-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS COLEY PHARMACEUTICAL GROUP, INC. 2009-10-29 US disclosed
US-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS COLEY PHARMACEUTICAL GROUP, INC. 2009-10-29 US disclosed
WO-2006026760-A2 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-09 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-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS IL2, IL4I1, IFNG NAAA 3155/4885KMT2A 3187/4885L3MBTL1 2506/4885

“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.