SCHEMBL18009406

SCHEMBL18009406

CCN(CC)C(=O)C[C@@H]1C[C@@H](OC(=O)/C=C/C(=O)OC)CN1C(=O)C(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 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
SCHEMBL18009400 0.88 KEAP1 (0.30) —
SCHEMBL18009341 0.88 KEAP1 (0.30) —
SCHEMBL18009407 0.84 PIK3CD (0.33) PIK3CD
SCHEMBL18009223 0.82 PIK3CD (0.32) PIK3CD
SCHEMBL18009358 0.82 PIK3CD (0.32) PIK3CD
SCHEMBL18009211 0.78 GLA (0.34) —
SCHEMBL18009388 0.76 PEPD (0.34) PIK3CD
SCHEMBL18009210 0.76 — —
SCHEMBL18009305 0.75 — —
SCHEMBL18009192 0.74 PIK3CD (0.36) PIK3CD

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
WO-2016127186-A1 FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE NGUYEN MARK QUANG (US) 2016-08-11 — — WO disclosed
Send feedback