SCHEMBL4775893

SCHEMBL4775893

Cc1nc(Cl)c([N+](=O)[O-])c(NCCOc2ccccc2)c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
APAF1 O14727 1/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43
ALPG P10696 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.39
GPR84 Q9NQS5 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39
MAPK1 P28482 1/20 0.39
CYP1A2 P05177 1/20 0.38

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
SCHEMBL4773504 0.96 MAPT (0.45) MAPTNPC1RAB9ASMN1; SMN2APAF1
SCHEMBL4773614 0.85 MAPT (0.47) MAPTNPC1RAB9ASMN1; SMN2APAF1
SCHEMBL4776209 0.84 LMNA (0.41) MAPTSMN1; SMN2GAALMNAALDH1A1
SCHEMBL4767732 0.80 HTR7 (0.43) NPC1RAB9ADRD2DRD4DRD3
SCHEMBL2574294 0.80 SMN1; SMN2 (0.47) MAPTSMN1; SMN2POLBTDP1LMNA
SCHEMBL4773502 0.78 MGMT (0.38) MAPTSMN1; SMN2POLBGAALMNA
SCHEMBL4775385 0.78 POLB (0.41) MAPTSMN1; SMN2POLBTDP1LMNA
SCHEMBL4772531 0.78 POLB (0.41) MAPTNPC1RAB9ASMN1; SMN2POLB
SCHEMBL4776141 0.76 POLB (0.43) MAPTNPC1RAB9ASMN1; SMN2POLB
SCHEMBL4770133 0.76 SMN1; SMN2 (0.44) MAPTSMN1; SMN2POLBTDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513524-A4 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES CO (US) 2008-09-03 EP disclosed
US-7220758-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-22 US disclosed
US-20060252792-A1 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2006-11-09 US disclosed
US-7125890-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-10-24 US disclosed
EP-1513524-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M Innovative Properties Company (US) 2005-03-16 EP disclosed
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors 3M INNOVATIVE PROPERTIES COMPANY 2005-02-10 US disclosed
US-6797718-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-09-28 US disclosed
US-20040010007-A1 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-01-15 US disclosed
WO-2003103584-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-12-18 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 (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-20060252792-A1 ETHER SUBSTITUTED IMIDAZOPYRIDINES IL2, IL4, MYD88 MAPT 4044/4885NPC1 3237/4885RAB9A 3015/4885
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors IL2, IFNG, TSLP MAPT 4354/4885NPC1 3418/4885RAB9A 2659/4885
US-20040010007-A1 Ether substituted imidazopyridines IL2, IL4, MYD88 MAPT 4044/4885NPC1 3237/4885RAB9A 3015/4885

“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.