SCHEMBL9686207

SCHEMBL9686207

[CH2]c1c(C)cccc1NC(=O)OCC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.59
HPGD P15428 1/20 0.59
NLRP3 Q96P20 5/20 0.58
SMN1; SMN2 Q16637 1/20 0.55
CYP1A2 P05177 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.47
HSD17B10 Q99714 1/20 0.47
HTT P42858 1/20 0.46
PTPN1 P18031 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
GAA P10253 1/20 0.46
MAPK13 O15264 1/20 0.45

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
SCHEMBL5839856 0.85 HPGD (0.49) ALDH1A1HPGDNLRP3NPC1RAB9A
SCHEMBL9687318 0.84 NPC1 (0.76) ALDH1A1HPGDNLRP3SMN1; SMN2NPC1
SCHEMBL1955909 0.83 NLRP3 (0.80) ALDH1A1HPGDNLRP3SMN1; SMN2CYP1A2
SCHEMBL69360 0.83 NPC1 (0.71) ALDH1A1HPGDNLRP3SMN1; SMN2CYP1A2
SCHEMBL30593915 0.83 NPC1 (0.71) ALDH1A1HPGDNLRP3SMN1; SMN2CYP1A2
SCHEMBL1024873 0.82 NLRP3 (0.65) ALDH1A1HPGDNLRP3SMN1; SMN2CYP1A2
SCHEMBL9342000 0.81 ALDH1A1 (0.78) ALDH1A1HPGDNLRP3SMN1; SMN2CYP1A2
SCHEMBL28401182 0.81 ALDH1A1 (0.72) ALDH1A1HPGDNLRP3SMN1; SMN2CYP1A2
SCHEMBL6287116 0.81 ALDH1A1 (0.59) ALDH1A1HPGDNLRP3SMN1; SMN2CYP1A2
SCHEMBL5541355 0.80 ALDH1A1 (0.62) ALDH1A1HPGDNLRP3SMN1; SMN2CYP1A2

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-0268989-B1 IMIDAZOPYRIDINE COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-07-08 EP claimed
US-4831041-A ANTIULCER AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-05-16 US claimed
EP-0268989-A1 Imidazopyridine compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-06-01 EP claimed
EP-0268989-B1 IMIDAZOPYRIDINE COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-07-08 EP disclosed
US-4831041-A ANTIULCER AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-05-16 US disclosed
EP-0268989-A1 Imidazopyridine compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-06-01 EP disclosed