Imidazole

Imidazole

SCHEMBL6401213

CCCCCCCCCCCCCCCCCCN(C)CCCCCCCCCCCCCCCCCC.Fc1c(F)c(F)c([Al](c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F.Fc1c(F)c(F)c([Al](c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F.c1c[nH]cn1

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
FKBP5 Q13451 1/20 0.33
KDM5A P29375 1/20 0.31
HTR7 P34969 2/20 0.31
S1PR2 O95136 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
S1PR5 Q9H228 1/20 0.31

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
Imidazole SCHEMBL7070534 0.85 ALDH1A1 (0.33) ALDH1A1FKBP5KDM5AS1PR2S1PR1
Imidazole SCHEMBL22163886 0.78 ALDH1A1 (0.54) ALDH1A1FKBP5
SCHEMBL7635638 0.77 HRH3 (0.56)
Imidazole SCHEMBL28506943 0.76 DNM1 (0.54) ALDH1A1FKBP5
Tetradecane SCHEMBL28143659 0.73 ALDH1A1 (0.62) ALDH1A1FKBP5
Octane SCHEMBL28359677 0.73 ALDH1A1 (0.62) ALDH1A1FKBP5
Decane SCHEMBL27806237 0.73 ALDH1A1 (0.62) ALDH1A1FKBP5
Heptane SCHEMBL28173922 0.73 ALDH1A1 (0.62) ALDH1A1FKBP5
Imidazole SCHEMBL27756359 0.73 ALDH1A1 (0.62) ALDH1A1FKBP5
Hexadecane SCHEMBL28142957 0.73 ALDH1A1 (0.62) ALDH1A1FKBP5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6891005-B2 Bridged metal complexes for gas phase polymerizations BP CHEMICALS LIMITED (GB) 2005-05-10 US disclosed
US-20030199650-A1 Bridged metal complexes for gas phase polymerizations BP CHEMICALS LIMITED 2003-10-23 US disclosed
EP-1141034-B1 BRIDGED METAL COMPLEXES FOR GAS PHASE POLYMERIZATIONS BP CHEM INT LTD (GB) 2002-10-30 EP disclosed
EP-1141034-A2 BRIDGED METAL COMPLEXES FOR GAS PHASE POLYMERIZATIONS BP Chemicals Limited (GB) 2001-10-10 EP disclosed
WO-2000020462-A2 BRIDGED METAL COMPLEXES FOR GAS PHASE POLYMERIZATIONS BP CHEMICALS LIMITED (GB) 2000-04-13 WO disclosed