SCHEMBL6099876

SCHEMBL6099876

Nc1c([N+](=O)[O-])c2nnnn2c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.40
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 5/20 0.36
RAB9A P51151 4/20 0.36
NPC1 O15118 4/20 0.36
NPSR1 Q6W5P4 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TLR9 Q9NR96 2/20 0.36
XBP1 P17861 1/20 0.36
PAX8 Q06710 1/20 0.36
POLB P06746 2/20 0.35
CYP3A4 P08684 1/20 0.35
TACR1 P25103 4/20 0.35
TNKS O95271 1/20 0.35
S100A4 P26447 1/20 0.34

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
SCHEMBL6106397 0.83 ALDH1A1 (0.51) LMNAALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL6097459 0.83 S100A4 (0.47) LMNAALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL3358573 0.83 HASPIN (0.39) LMNAALDH1A1MAPTPOLBHTT
Water SCHEMBL6101423 0.82 S100A4 (0.46) LMNAALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL842477 0.81 NPY1R (0.36) LMNAALDH1A1KDM4ESMN1; SMN2MAPT
SCHEMBL3355530 0.81 NPY1R (0.36) LMNAALDH1A1KDM4ESMN1; SMN2MAPT
SCHEMBL6100932 0.79 S100A4 (0.34) LMNAALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL6100934 0.79 S100A4 (0.34) LMNAALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL6106735 0.79 KDM4E (0.43) LMNAALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL6100506 0.77 MAPT (0.47) LMNAALDH1A1KDM4ESMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7026482-B2 Process for preparing imidazoquinolinamines MEDICIS PHARMACEUTICAL CORPORATION 2006-04-11 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-6897314-B2 Process for preparing imidazoquinolinamines 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-05-24 US disclosed
US-20050096470-A1 Process for preparing imidazoquinolinamines 3M INNOVATIVE PROPERTIES COMPANY 2005-05-05 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-20040072858-A1 Heterocyclic ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-04-15 US disclosed
EP-0912565-B1 PROCESS FOR PREPARING IMIDAZOQUINOLINAMINES MINNESOTA MINING & MFG (US) 2004-04-14 EP disclosed
US-20040019213-A1 Process for preparing imidazoquinolinamines 3M INNOVATIVE PROPERTIES COMPANY 2004-01-29 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
US-6150523-A Process for preparing imidazoquinolinamines 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-11-21 US disclosed
US-5998619-A Process for preparing imidazoquinolinamines 3M INNOVATIVE PROPERTIES COMPANY (US) 1999-12-07 US disclosed
EP-0912565-A1 PROCESS FOR PREPARING IMIDAZOQUINOLINAMINES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-05-06 EP disclosed
EP-0912564-A1 PROCESS FOR PREPARING TETRAHYDROIMIDAZOQUINOLINAMINES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-05-06 EP disclosed
US-5741908-A Process for reparing imidazoquinolinamines MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-04-21 US disclosed
WO-1997048703-A1 PROCESS FOR PREPARING TETRAHYDROIMIDAZOQUINOLINAMINES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-12-24 WO disclosed
WO-1997048704-A1 PROCESS FOR PREPARING IMIDAZOQUINOLINAMINES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-12-24 WO disclosed
US-5693811-A Process for preparing tetrahdroimidazoquinolinamines MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-12-02 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 (5 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 LMNA 3956/4885ALDH1A1 1364/4885KDM4E 419/4885
US-20040106640-A1 Aryl ether substituted imidazoquinolines IRF3, IFNG, MYD88 LMNA 3956/4885ALDH1A1 1364/4885KDM4E 419/4885
US-20040019213-A1 Process for preparing imidazoquinolinamines VAT1, QARS1, TALDO1 LMNA 1618/4885ALDH1A1 1648/4885KDM4E 692/4885
US-20050096470-A1 Process for preparing imidazoquinolinamines ITPA, INMT, PIP4K2C LMNA 1093/4885ALDH1A1 1777/4885KDM4E 983/4885
US-20040072858-A1 Heterocyclic ether substituted imidazoquinolines IFNG, IL2, IRF3 LMNA 3958/4885ALDH1A1 2486/4885KDM4E 752/4885

“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.