SCHEMBL2831202

SCHEMBL2831202

O=S(=O)(c1ccc(Br)cc1)N1CCC2(CC1)OCCO2

nearest known ligand 0.77

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.77
POLB P06746 3/20 0.73
PKM P14618 1/20 0.63
ALDH1A1 P00352 3/20 0.57
LMNA P02545 2/20 0.55
TSHR P16473 1/20 0.55
HTT P42858 1/20 0.55
MAPK1 P28482 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
ATM Q13315 1/20 0.52

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
SCHEMBL12793323 0.86 KDM4E (0.79) KDM4EPOLBPKMALDH1A1LMNA
SCHEMBL4009309 0.84 KDM4E (0.77) KDM4EPOLBPKMALDH1A1LMNA
SCHEMBL12386397 0.84 KDM4E (0.77) KDM4EPOLBPKMALDH1A1LMNA
SCHEMBL5306415 0.84 POLB (1.00) KDM4EPOLBPKMALDH1A1LMNA
SCHEMBL2080837 0.84 KDM4E (0.77) KDM4EPOLBPKMALDH1A1LMNA
SCHEMBL6154077 0.84 POLB (1.00) KDM4EPOLBPKMALDH1A1LMNA
SCHEMBL4537988 0.83 SMN1; SMN2 (0.72) KDM4EPOLBALDH1A1LMNATSHR
SCHEMBL2299329 0.81 KDM4E (0.71) KDM4EPOLBPKMALDH1A1LMNA
SCHEMBL12386392 0.81 KDM4E (0.71) KDM4EPOLBPKMALDH1A1LMNA
SCHEMBL2297718 0.81 KDM4E (0.71) KDM4EPOLBPKMALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100216790-A1 IMIDAZOPYRIDINE-DERIVATIVES AS INDUCIBLE NO-SYNTHASE INHIBITORS ALTANA PHARMA AG (DE) 2010-08-26 US disclosed
US-7709488-B2 Imidazopyridine-derivatives as inducible no-synthase inhibitors ALTANA PHARMA AG (DE) 2010-05-04 US disclosed
EP-1670796-B1 IMIDAZOPYRIDINE-DERIVATIVES AS INDUCIBLE NO-SYNTHASE INHIBITORS NYCOMED GMBH (DE) 2008-06-25 EP disclosed
US-7279488-B2 Imidazopyridine-derivatives as inducible no-synthase inhibitors NYCOMED GMBH (DE) 2007-10-09 US disclosed
US-20060293302-A1 Imidazopyridine-derivatives as inducible no-synthase inhibitors ALTANA PHARMA AG (DE) 2006-12-28 US disclosed
EP-1670796-A1 IMIDAZOPYRIDINE-DERIVATIVES AS INDUCIBLE NO-SYNTHASE INHIBITORS ALTANA Pharma AG (DE) 2006-06-21 EP disclosed
WO-2005030770-A1 IMIDAZOPYRIDINE-DERIVATIVES AS INDUCIBLE NO-SYNTHASE INHIBITORS ALTANA PHARMA AG (DE) 2005-04-07 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 (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-20060293302-A1 Imidazopyridine-derivatives as inducible no-synthase inhibitors NOS2, NOS1, NOS3 KDM4E 2060/4885POLB 2445/4885PKM 2251/4885
US-20100216790-A1 IMIDAZOPYRIDINE-DERIVATIVES AS INDUCIBLE NO-SYNTHASE INHIBITORS NOS2, NOS1, NOS3 KDM4E 2060/4885POLB 2445/4885PKM 2251/4885

“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.