SCHEMBL6104993

SCHEMBL6104993

CCCCc1nc2cnc3ccccc3c2n1CCOc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
TLR7 Q9NYK1 11/20 0.49
TLR8 Q9NR97 1/20 0.48
ADORA3 P0DMS8 1/20 0.47
TSHR P16473 2/20 0.47
ALDH1A1 P00352 1/20 0.47
PKM P14618 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL6105540 0.88 SMN1; SMN2 (0.53) HPGDSMN1; SMN2TLR7TSHRALDH1A1
SCHEMBL3353817 0.87 SMN1; SMN2 (0.56) HPGDSMN1; SMN2TLR7TLR8ADORA3
SCHEMBL6106393 0.86 TLR7 (0.53) TLR7TLR8PDE4APDE4BPDE4C
SCHEMBL1486523 0.85 SMN1; SMN2 (0.47) HPGDSMN1; SMN2TLR7TLR8ADORA3
SCHEMBL6105345 0.85 TLR7 (0.53) TLR7TLR8PDE4APDE4BPDE4C
SCHEMBL4794467 0.85 ALDH1A1 (0.51) SMN1; SMN2TLR7TLR8TSHRALDH1A1
SCHEMBL6106231 0.84 TLR7 (0.43) HPGDSMN1; SMN2TLR7TLR8ADORA3
SCHEMBL5616044 0.84 TLR7 (0.47) SMN1; SMN2TLR7TLR8ALDH1A1PDE4A
SCHEMBL27777013 0.84 TLR7 (0.50) TLR7TLR8ADORA3PDE4APDE4B
SCHEMBL5356378 0.84 TLR7 (0.52) TLR7TLR8PDE4APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6989389-B2 Aryl ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES CO. (US) 2006-01-24 US disclosed
US-6953804-B2 Aryl ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES CO. (US) 2005-10-11 US disclosed
US-20040138248-A1 Aryl ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-07-15 US disclosed
US-20040106640-A1 Aryl ether substituted imidazoquinolines COLEY PHARMACEUTICAL GROUP, INC. 2004-06-03 US disclosed
US-6677348-B2 INDUCE CYTOKINE BIOSYNTHESIS; ANTICARCINOGENIC AGENTS, VIRICIDES 3M INNOVATIVE PROPERTIES COMPANY 2004-01-13 US disclosed
US-6670372-B2 Immunomodulators, for inducing cytokine biosynthesis in animals, and in the treatment of viral and neoplastic diseases; imidazo(4,5-c) quinoline-4-amine compounds that have an ether containing substituent at the 1-position 3M INNOVATIVE PROPERTIES COMPANY 2003-12-30 US disclosed
US-20030212092-A1 Aryl ether substituted imidazoquinolines COLEY PHARMACEUTICAL GROUP, INC. 2003-11-13 US disclosed
US-20030212091-A1 Aryl ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2003-11-13 US disclosed
EP-1341789-A2 ARYL ETHER SUBSTITUTED IMIDAZOQUINOLINES 3M Innovative Properties Company (US) 2003-09-10 EP disclosed
WO-2002046189-A2 ARYL 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 (4 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-20040138248-A1 Aryl ether substituted imidazoquinolines IRF3, IFNG, MYD88 HPGD 1542/4885SMN1; SMN2 4018/4885TLR7 20/4885
US-20040106640-A1 Aryl ether substituted imidazoquinolines IRF3, IFNG, MYD88 HPGD 1542/4885SMN1; SMN2 4018/4885TLR7 20/4885
US-20030212092-A1 Aryl ether substituted imidazoquinolines IRF3, IFNG, MYD88 HPGD 1542/4885SMN1; SMN2 4018/4885TLR7 20/4885
US-20030212091-A1 Aryl ether substituted imidazoquinolines IRF3, IFNG, MYD88 HPGD 1542/4885SMN1; SMN2 4018/4885TLR7 20/4885

“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.