SCHEMBL5356574

SCHEMBL5356574

c1ccc(Oc2nc3c(c4[nH]cnc24)CCCC3)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 8/20 0.41
ACHE P22303 8/20 0.41
ALDH1A1 P00352 5/20 0.37
ADORA3 P0DMS8 2/20 0.37
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
TSHR P16473 4/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 2/20 0.35
KCNH2 Q12809 2/20 0.35
HSD17B10 Q99714 2/20 0.35
CACNB4 O00305 1/20 0.35
CACNA1A O00555 1/20 0.35
SLC22A2 O15244 1/20 0.35
SLC22A1 O15245 1/20 0.35
ABCC4 O15439 1/20 0.35
CACNA1G O43497 1/20 0.35
CACNG3 O60359 1/20 0.35

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
SCHEMBL6104398 0.73 HTT (0.46) ALDH1A1ADORA3KMT2AKDM4EMAPT
SCHEMBL1140881 0.71 ACHE (0.41) BCHEACHEALDH1A1ADORA3TSHR
SCHEMBL2707307 0.71 NSD2 (0.40) BCHEACHEALDH1A1SMN1; SMN2KDM4E
SCHEMBL8121994 0.71 HPGD (0.50) BCHEACHEADORA3TSHRMEN1
SCHEMBL4794106 0.71 TRPA1 (0.37) ALDH1A1ADORA3ADORA2AADORA1TSHR
SCHEMBL24287266 0.70 LMNA (0.57) BCHEACHEALDH1A1ADORA3TSHR
SCHEMBL6244651 0.70 ACHE (0.40) BCHEACHEALDH1A1ADORA3TSHR
SCHEMBL3818922 0.69 USP2 (0.35) SMN1; SMN2MEN1KMT2AKCNH2CYP1A2
SCHEMBL6930107 0.68 ACHE (0.40) BCHEACHEALDH1A1ADORA2ASMN1; SMN2
SCHEMBL24287389 0.67 LMNA (0.57) BCHEACHEALDH1A1SMN1; SMN2TSHR

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276515-B2 Thioether substituted imidazoquinolines COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-10-02 US disclosed
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-6949649-B2 Thioether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES CO. (US) 2005-09-27 US disclosed
US-20050209268-A1 Thioether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2005-09-22 US disclosed
EP-1451191-A1 THIOETHER SUBSTITUTED IMIDAZOQUINOLINES 3M Innovative Properties Company (US) 2004-09-01 EP 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-20040097736-A1 Thioether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-05-20 US disclosed
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
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
EP-1339715-A2 HETEROCYCLIC ETHER SUBSTITUTED IMIDAZOQUINOLINES 3M Innovative Properties Company (US) 2003-09-03 EP disclosed
WO-2003050121-A1 THIOETHER SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-06-19 WO disclosed
US-20030100764-A1 Thioether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2003-05-29 US 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
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 (9 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 BCHE 4121/4885ACHE 4670/4885ALDH1A1 2486/4885
US-20040138248-A1 Aryl ether substituted imidazoquinolines IRF3, IFNG, MYD88 BCHE 4586/4885ACHE 4824/4885ALDH1A1 1364/4885
US-20040106640-A1 Aryl ether substituted imidazoquinolines IRF3, IFNG, MYD88 BCHE 4586/4885ACHE 4824/4885ALDH1A1 1364/4885
US-20050209268-A1 Thioether substituted imidazoquinolines IFNG, IRF3, IL2 BCHE 4028/4885ACHE 4781/4885ALDH1A1 2256/4885
US-20040097736-A1 Thioether substituted imidazoquinolines IFNG, IRF3, IL2 BCHE 4028/4885ACHE 4781/4885ALDH1A1 2256/4885
US-20030212092-A1 Aryl ether substituted imidazoquinolines IRF3, IFNG, MYD88 BCHE 4586/4885ACHE 4824/4885ALDH1A1 1364/4885
US-20030100764-A1 Thioether substituted imidazoquinolines IFNG, IRF3, IL2 BCHE 4028/4885ACHE 4781/4885ALDH1A1 2256/4885
US-20030212091-A1 Aryl ether substituted imidazoquinolines IRF3, IFNG, MYD88 BCHE 4586/4885ACHE 4824/4885ALDH1A1 1364/4885
US-20040072858-A1 Heterocyclic ether substituted imidazoquinolines IFNG, IL2, IRF3 BCHE 4121/4885ACHE 4670/4885ALDH1A1 2486/4885

“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.