SCHEMBL4766494

SCHEMBL4766494

CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1NC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
POLB P06746 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 2/20 0.41
GALR2 O43603 1/20 0.41
MITF O75030 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HPGD P15428 1/20 0.41
XBP1 P17861 1/20 0.41
CCR6 P51684 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KDM4E B2RXH2 4/20 0.40
MAPT P10636 7/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
GAA P10253 1/20 0.40
PKM P14618 1/20 0.40
MAPK1 P28482 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL4246885 0.89 ALDH1A1 (0.45) ALDH1A1POLBSMN1; SMN2LMNAGALR2
SCHEMBL4073798 0.87 ALDH1A1 (0.43) ALDH1A1POLBSMN1; SMN2LMNAGALR2
SCHEMBL574989 0.84 ALDH1A1 (0.49) ALDH1A1POLBSMN1; SMN2LMNAGALR2
SCHEMBL30846439 0.84 ALDH1A1 (0.49) ALDH1A1POLBSMN1; SMN2LMNAGALR2
SCHEMBL27314724 0.84 ALDH1A1 (0.49) ALDH1A1POLBSMN1; SMN2LMNAGALR2
SCHEMBL4067929 0.83 MEN1 (0.42) ALDH1A1POLBSMN1; SMN2HPGDKDM4E
SCHEMBL17042260 0.82 NPSR1 (0.55) ALDH1A1POLBSMN1; SMN2LMNAHPGD
SCHEMBL14031475 0.82 ALDH1A1 (0.47) ALDH1A1POLBSMN1; SMN2LMNAGALR2
SCHEMBL4497497 0.82 ALDH1A1 (0.47) ALDH1A1POLBSMN1; SMN2HSP90AA1HPGD
SCHEMBL15413264 0.81 KDM4E (0.45) ALDH1A1POLBHPGDKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101282973-A Imidazopyridine derivatives as cannabinoid receptor ligands GLAXO GROUP LTD (GB) 2008-10-08 CN disclosed
WO-2008116816-A1 COMBINATION OF CB2 LIGAND AND PARACETAMOL GLAXO GROUP LIMITED (GB) 2008-10-02 WO disclosed
US-20080221097-A1 Imidazopyridine Derivatives as Cannabinoid Receptor Ligands GLAXO GROUP LIMITED 2008-09-11 US disclosed
US-20080221097-A1 Imidazopyridine Derivatives as Cannabinoid Receptor Ligands GLAXO GROUP LIMITED 2008-09-11 US disclosed
EP-1912985-A1 IMIDAZOPYRIDINE DERIVATIVES AS CANNABINOID RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2008-04-23 EP disclosed
WO-2007017237-A1 IMIDAZOPYRIDINE DERIVATIVES AS CANNABINOID RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2007-02-15 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 (1 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-20080221097-A1 Imidazopyridine Derivatives as Cannabinoid Receptor Ligands CNR1, CNR2, TRPV1 ALDH1A1 3269/4885POLB 4206/4885SMN1; SMN2 2518/4885

“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.