Imidazole

Imidazole

SCHEMBL21294097

CCc1nc(C)cn1CCC#N.c1c[nH]cn1

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
CYP19A1 P11511 1/20 0.33
FKBP5 Q13451 1/20 0.33
KDM4E B2RXH2 1/20 0.32
HIF1A Q16665 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL138437 0.86 CYP19A1 (0.40) ALDH1A1CYP19A1KDM4EHIF1ANPSR1
SCHEMBL11002771 0.81 PDE4A (0.39) ALDH1A1CYP19A1KDM4EHIF1ANPSR1
SCHEMBL11286963 0.75 PDE4A (0.35) ALDH1A1CYP19A1KDM4EHIF1ANPSR1
SCHEMBL3686291 0.74 CYP19A1 (0.42) ALDH1A1CYP19A1
SCHEMBL10867322 0.70 SPNS2 (0.36) ALDH1A1CYP19A1KDM4EHIF1ANPSR1
SCHEMBL543250 0.69 CSNK2A1 (0.39) ALDH1A1KDM4EHIF1ANPSR1
SCHEMBL9645498 0.69 CYP19A1 (0.45) ALDH1A1CYP19A1
SCHEMBL473284 0.69 CYP19A1 (0.41) ALDH1A1CYP19A1KDM4E
SCHEMBL28747393 0.68 PDE10A (0.34) ALDH1A1CYP19A1KDM4E
SCHEMBL16267964 0.66 CYP19A1 (0.47) ALDH1A1CYP19A1

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
CN-104673432-A Graphene @Fe3O4 compound organic magnetorheological fluid and preparation method thereof UNIV NORTH CHINA 2015-06-03 CN claimed
US-10850512-B2 Ink jet recording head and method of manufacturing same CANON KABUSHIKI KAISHA (JP) 2020-12-01 US disclosed
US-20190263117-A1 INK JET RECORDING HEAD AND METHOD OF MANUFACTURING SAME CANON KABUSHIKI KAISHA (JP) 2019-08-29 US disclosed
CN-107108892-A Polythioether sealants with extended processing time PRC-迪索托国际公司 2017-08-29 CN disclosed
CN-104673432-B Graphene @Fe3O4 compound organic magnetorheological fluid and preparation method thereof 中北大学 2017-04-19 CN disclosed
CN-104673432-A Graphene @Fe3O4 compound organic magnetorheological fluid and preparation method thereof UNIV NORTH CHINA 2015-06-03 CN disclosed