SCHEMBL5362240

SCHEMBL5362240

COC(C)c1nc2cnc3ccccc3c2n1CCNC(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
DRD2 P14416 1/20 0.39
TLR7 Q9NYK1 2/20 0.38
AAK1 Q2M2I8 1/20 0.38
SCN9A Q15858 1/20 0.38
BRD4 O60885 2/20 0.37
CKS1B P61024 1/20 0.37
SKP1 P63208 1/20 0.37
SKP2 Q13309 1/20 0.37
DYRK1A Q13627 1/20 0.37

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
SCHEMBL5355169 0.84 TLR7 (0.52) TLR7
SCHEMBL5351277 0.83 BCHE (0.38) BCHEMEN1NPC1GAARAB9A
SCHEMBL1233136 0.83 TLR7 (0.43) BCHEMEN1NPC1GAARAB9A
SCHEMBL5362245 0.81 TLR7 (0.43) BCHEMEN1GAAKMT2ATLR7
SCHEMBL12888420 0.81 TLR7 (0.48) BCHETLR7
SCHEMBL6106028 0.80 MAPT (0.37) MEN1RAB9AKMT2ATLR7BRD4
SCHEMBL6494409 0.80 TLR7 (0.54) GAATLR7
SCHEMBL5350844 0.80 TLR7 (0.52) BCHETLR7
SCHEMBL5344983 0.79 DYRK1A (0.47) BCHEDRD2TLR7BRD4DYRK1A
SCHEMBL1232968 0.78 TLR7 (0.45) BCHEDRD2TLR7BRD4DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7157453-B2 Urea substituted imidazoquinolines 3M INNOVATION PROPERTIES COMPANY (US) 2007-01-02 US disclosed
US-20050131009-A1 Urea substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2005-06-16 US disclosed
US-6897221-B2 Urea substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-05-24 US disclosed
US-6784188-B2 ADMINISTERING TO A MAMMAL 1H-IMIDAZO(4,5-C)QUINOLINE RING CONTAINING COMPOUND FOR THE TREATMENT OF DISEASES, INCLUDING VIRAL AND NEOPLSATIC DISEASES 3M INNOVATIVE PROPERTIES COMPANY 2004-08-31 US disclosed
US-20040167154-A1 Urea substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-08-26 US disclosed
US-20040019048-A1 Urea substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-01-29 US 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 (3 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-20040167154-A1 Urea substituted imidazoquinolines IFNG, EIF2AK2, IRF3 BCHE 3289/4885MEN1 3889/4885NPC1 2245/4885
US-20040019048-A1 Urea substituted imidazoquinolines IFNG, EIF2AK2, IRF3 BCHE 3289/4885MEN1 3889/4885NPC1 2245/4885
US-20050131009-A1 Urea substituted imidazoquinolines IFNG, EIF2AK2, IRF3 BCHE 3289/4885MEN1 3889/4885NPC1 2245/4885

“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.