SCHEMBL310065

SCHEMBL310065

Cc1c(OCCN)cccc1[N+](=O)[O-]

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.56
RAB9A P51151 3/20 0.56
RECQL P46063 2/20 0.56
TDP1 Q9NUW8 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.50
TSHR P16473 2/20 0.50
KMT2A Q03164 3/20 0.48
MAPT P10636 2/20 0.48
MAPK1 P28482 2/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 5/20 0.48
LMNA P02545 2/20 0.48
KDM4E B2RXH2 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.43
HTR1B P28222 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL26132980 0.86 RAB9A (0.57) NPC1RAB9ARECQLTDP1SMN1; SMN2
SCHEMBL10263950 0.84 NPC1 (0.56) NPC1RAB9ARECQLTDP1SMN1; SMN2
SCHEMBL8489668 0.84 NPC1 (0.56) NPC1RAB9ARECQLTDP1SMN1; SMN2
SCHEMBL3810527 0.83 NPC1 (0.79) NPC1RAB9ARECQLTDP1SMN1; SMN2
SCHEMBL28436127 0.83 NPC1 (0.54) NPC1RAB9ARECQLTDP1SMN1; SMN2
SCHEMBL13981471 0.82 NPC1 (0.50) NPC1RAB9ARECQLTDP1SMN1; SMN2
Hydrochloric Acid SCHEMBL29489495 0.82 NPC1 (0.77) NPC1RAB9ARECQLTDP1SMN1; SMN2
SCHEMBL30072726 0.82 TDP1 (0.60) NPC1RAB9ARECQLTDP1SMN1; SMN2
SCHEMBL1141627 0.82 TDP1 (0.60) NPC1RAB9ARECQLTDP1SMN1; SMN2
SCHEMBL9506168 0.82 NPC1 (0.53) NPC1RAB9ARECQLTDP1SMN1; SMN2

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
EP-2162454-B1 IMIDAZOPYRIDINE KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-01-02 EP disclosed
US-8093239-B2 Imidazopyridine kinase inhibitors GLAXOSMITHKLINE LLC (US) 2012-01-10 US disclosed
US-20100216779-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2010-08-26 US disclosed
EP-2162454-A1 IMIDAZOPYRIDINE KINASE INHIBITORS GlaxoSmithKline LLC (US) 2010-03-17 EP disclosed
WO-2008150799-A1 IMIDAZOPYRIDINE KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-12-11 WO disclosed
US-20080300242-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2008-12-04 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 (2 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-20080300242-A1 Imidazopyridine Kinase Inhibitors ABL1, MAP3K19, MAP3K5 NPC1 2713/4885RAB9A 1901/4885RECQL 2232/4885
US-20100216779-A1 Imidazopyridine Kinase Inhibitors ABL1, MAP3K19, MAP3K5 NPC1 2713/4885RAB9A 1901/4885RECQL 2232/4885

“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.