SCHEMBL31403683

SCHEMBL31403683

COC(=O)c1cnc2[nH]ccc2c1F

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 8/20 0.46
JAK1 P23458 7/20 0.46
AXL P30530 6/20 0.46
NUDT1 P36639 1/20 0.46
MAP2K1 Q02750 1/20 0.46
TTBK1 Q5TCY1 1/20 0.45
TTBK2 Q6IQ55 1/20 0.45
CDK8 P49336 1/20 0.42
PRKCI P41743 1/20 0.41
MGLL Q99685 1/20 0.40
JAK2 O60674 1/20 0.40

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
SCHEMBL21632535 1.00 JAK3 (0.46) JAK3JAK1AXLNUDT1MAP2K1
SCHEMBL16940954 0.84 JAK3 (0.50) JAK3JAK1AXLNUDT1MAP2K1
SCHEMBL2632955 0.83 NUDT1 (0.50) JAK3JAK1AXLNUDT1MAP2K1
SCHEMBL31403755 0.83 NUDT1 (0.50) JAK3JAK1AXLNUDT1MAP2K1
SCHEMBL21816126 0.83 MGLL (0.42) JAK3JAK1AXLNUDT1PRKCI
SCHEMBL31175280 0.83 MGLL (0.42) JAK3JAK1AXLNUDT1PRKCI
SCHEMBL25280494 0.82 AXL (0.46) JAK3JAK1AXLNUDT1MAP2K1
SCHEMBL2115690 0.82 AXL (0.55) JAK3JAK1AXLNUDT1MAP2K1
SCHEMBL30985188 0.82 AXL (0.55) JAK3JAK1AXLNUDT1MAP2K1
SCHEMBL29656385 0.82 TTBK1 (0.48) JAK3JAK1AXLNUDT1MAP2K1

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-2025076284-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME DELPHIA THERAPEUTICS, INC. (US) 2025-04-10 WO disclosed