SCHEMBL29337231

SCHEMBL29337231

C=C1COCc2cc(Br)cnc21

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 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
SCHEMBL29337232 0.79 DYRK1A (0.33) DYRK1AHTTKMT2A
SCHEMBL29337254 0.79
SCHEMBL29875744 0.75 ALDH1A1 (0.42) HTT
SCHEMBL16415969 0.73 HTT (0.34) DYRK1AHTTKMT2A
SCHEMBL15595083 0.71 DYRK1A (0.32) DYRK1A
SCHEMBL25218349 0.69 MAOA (0.38) DYRK1AHTTKMT2A
SCHEMBL29915220 0.69 MAOA (0.38) DYRK1AHTTKMT2A
SCHEMBL29337519 0.68
SCHEMBL15290415 0.68 HTT (0.39) DYRK1AHTTKMT2A
SCHEMBL17802101 0.67 METAP1 (0.49) HTT

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-2024148191-A1 MODULATORS OF TNF-α ACTIVITY FORWARD THERAPEUTICS, INC. (US) 2024-07-11 WO disclosed