SCHEMBL6528384

SCHEMBL6528384

C=CCc1[c]c2nnsc2cc1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL21617926 0.65 GABRA1 (0.34) MEN1KMT2A
SCHEMBL6921384 0.63 GABRA1 (0.33) MEN1KMT2A
SCHEMBL252157 0.63 GABRA1 (0.45) MEN1KMT2A
SCHEMBL5888984 0.62 GABRA1 (0.46) MEN1KMT2A
SCHEMBL5067880 0.61 GABRA1 (0.41) MEN1KMT2A
SCHEMBL5136127 0.58 GABRA1 (0.41) MEN1KMT2A
SCHEMBL10339964 0.58 ALOX5 (0.46) MEN1KMT2A
SCHEMBL252125 0.57 GABRA1 (0.32)
SCHEMBL3980459 0.57
SCHEMBL14877373 0.56 ALDH1A1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6969728-B2 Antiinflammatory agents GENZYME CORPORATION (US) 2005-11-29 US claimed