SCHEMBL6700923

SCHEMBL6700923

Cc1nc2c(Oc3ccccc3)nc3c(c2n1CCOCCCc1cccnc1)CCCC3

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
BLM P54132 1/20 0.35
FKBP1A P62942 3/20 0.34
PTAFR P25105 1/20 0.34
PKM P14618 1/20 0.34
TBXA2R P21731 2/20 0.34
TBXAS1 P24557 2/20 0.34
HRH3 Q9Y5N1 1/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 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
SCHEMBL6694757 0.85 TLR7 (0.36) MAPTNPSR1TDP1BLMFKBP1A
SCHEMBL4794435 0.85 CHRNA7 (0.35) TDP1FKBP1APTAFRHRH3
SCHEMBL6698442 0.74 BCHE (0.46) HRH3BCHEACHE
SCHEMBL4795133 0.74 TLR8 (0.40) MAPTNPSR1TDP1PTAFR
SCHEMBL5348190 0.73 NPC1 (0.32) BCHEACHE
SCHEMBL30200896 0.72 TLR7 (0.57)
SCHEMBL483652 0.72 TLR7 (0.57)
SCHEMBL5355562 0.72 BCHE (0.32) BCHEACHE
SCHEMBL5406199 0.72 BCHE (0.32) HRH3BCHEACHE
SCHEMBL5366471 0.71 HTT (0.35) BCHEACHE

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-20040072858-A1 Heterocyclic ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-04-15 US disclosed
US-6664260-B2 Viricides; anticarcinogneic agents; induction cytokine biosynthesis 3M INNOVATIVE PROPERTIES COMPANY 2003-12-16 US disclosed
EP-1339715-A2 HETEROCYCLIC ETHER SUBSTITUTED IMIDAZOQUINOLINES 3M Innovative Properties Company (US) 2003-09-03 EP disclosed
US-20030065005-A1 Heterocyclic ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2003-04-03 US disclosed
WO-2002046193-A2 HETEROCYCLIC ETHER SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2002-06-13 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-20030065005-A1 Heterocyclic ether substituted imidazoquinolines IFNG, IL2, IRF3 MAPT 4130/4885NPSR1 4094/4885TDP1 3649/4885
US-20040072858-A1 Heterocyclic ether substituted imidazoquinolines IFNG, IL2, IRF3 MAPT 4130/4885NPSR1 4094/4885TDP1 3649/4885

“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.