SCHEMBL8674657

SCHEMBL8674657

O=CCc1nsc2nccn12

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F13A1 P00488 6/20 0.39
IDO1 P14902 1/20 0.31
TGM1 P22735 1/20 0.30

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
SCHEMBL7476084 0.66
SCHEMBL23197171 0.66 F13A1 (0.39) F13A1IDO1
SCHEMBL8894095 0.65 F13A1 (0.32) F13A1
SCHEMBL1107207 0.64
SCHEMBL515342 0.64
Formaldehyde SCHEMBL4033269 0.62 MEN1 (0.47)
SCHEMBL7481374 0.61 ALDH1A1 (0.42)
SCHEMBL7005904 0.60 F13A1 (0.65) F13A1TGM1
SCHEMBL27537786 0.60 ALDH1A1 (0.47)
SCHEMBL7534216 0.60 JMJD6 (0.40) F13A1

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-0883606-A1 PROCESS FOR SCAVENGING THIOLS APOTEX INC. (CA) 1998-12-16 EP disclosed
WO-1997031893-A1 PROCESS FOR SCAVENGING THIOLS APOTEX INC. (CA) 1997-09-04 WO disclosed