SCHEMBL6973526

SCHEMBL6973526

CN1C(Sc2cccc(Cl)c2)=C(CO)NC1(CO[SiH](C)C)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 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
SCHEMBL6967554 0.91 SLC6A2 (0.32) SLC6A2SLC6A4SLC6A3
SCHEMBL6972420 0.88 MEN1 (0.32)
SCHEMBL6966591 0.87 USP7 (0.32)
SCHEMBL6962753 0.82 MEN1 (0.32)
SCHEMBL6960405 0.81 MEN1 (0.31)
SCHEMBL6965870 0.62 ALDH1A1 (0.33) SLC6A2SLC6A4SLC6A3
SCHEMBL28621298 0.59 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3
SCHEMBL6972910 0.58 ALDH1A1 (0.35) SLC6A2SLC6A4SLC6A3
SCHEMBL6961234 0.58 TYMS (0.34) SLC6A2SLC6A4SLC6A3
SCHEMBL8345577 0.57 ALOX12 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0786455-B1 IMIDAZOLE DERIVATIVE SHIONOGI & CO (JP) 2003-12-03 EP disclosed
US-6147097-A METHOD FOR TREATING AIDS SHIONOGI & CO., LTD. (JP) 2000-11-14 US disclosed
EP-0786455-A1 IMIDAZOLE DERIVATIVE SHIONOGI & CO., LTD. (JP) 1997-07-30 EP disclosed