SCHEMBL3637477

SCHEMBL3637477

CONc1ccc(CCN2CCOCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 4/20 0.51
▸ EPHX2 P34913 1/20 0.49
▸ TNIK Q9UKE5 1/20 0.47
▸ HRH3 Q9Y5N1 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ L3MBTL3 Q96JM7 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ HIF1A Q16665 1/20 0.44
▸ EPAS1 Q99814 1/20 0.44

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
SCHEMBL14980018 0.83 SIGMAR1 (0.55) SIGMAR1EPHX2TNIKHRH3POLB
SCHEMBL15137345 0.81 SIGMAR1 (0.57) SIGMAR1EPHX2HRH3POLBL3MBTL3
SCHEMBL13283790 0.80 SIGMAR1 (0.53) SIGMAR1EPHX2TNIKHRH3POLB
SCHEMBL8009145 0.80 SIGMAR1 (0.55) SIGMAR1EPHX2TNIKHRH3POLB
SCHEMBL9069989 0.80 SIGMAR1 (0.77) SIGMAR1HRH3SMN1; SMN2
SCHEMBL5785769 0.79 GAA (0.60) SIGMAR1EPHX2HRH3ALDH1A1LMNA
SCHEMBL65840 0.79 SMN1; SMN2 (0.62) ALDH1A1LMNASMN1; SMN2MAPK1
SCHEMBL28069120 0.79 KDM4E (0.59) EPHX2HRH3ALDH1A1LMNASMN1; SMN2
SCHEMBL14100178 0.79 EPHX2 (0.50) SIGMAR1EPHX2HRH3ALDH1A1LMNA
SCHEMBL12606897 0.79 SIGMAR1 (0.51) SIGMAR1EPHX2TNIKHRH3POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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