SCHEMBL31387935

SCHEMBL31387935

COC(=O)c1cc(Br)ncc1C1CC1

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 19/20 0.42
▸ PDK2 Q15119 1/20 0.41
▸ PDK4 Q16654 1/20 0.41

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
SCHEMBL31208501 0.88 OPRK1 (0.42) OPRK1PDK2PDK4
SCHEMBL31133273 0.78 GAA (0.41) OPRK1
SCHEMBL23214285 0.78 GAA (0.41) OPRK1
SCHEMBL19813985 0.77 L3MBTL1 (0.41) OPRK1PDK2PDK4
SCHEMBL23012453 0.77 OPRK1 (0.41) OPRK1
SCHEMBL21713467 0.76 L3MBTL1 (0.40) OPRK1PDK2PDK4
SCHEMBL31216665 0.76 CA12 (0.49) OPRK1PDK2PDK4
SCHEMBL19278157 0.74 TSHR (0.41) OPRK1PDK2PDK4
SCHEMBL22674555 0.74 KDM4E (0.51) —
SCHEMBL2025343 0.74 SOS1 (0.40) OPRK1PDK2PDK4

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
CN-114341127-B Aminopyrazine compounds as HPK1 inhibitors and uses thereof 百济神州有限公司 2024-12-17 — — CN disclosed
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