SCHEMBL31196236

SCHEMBL31196236

O=C([C@H]1CC[C@H](COc2cc(Cl)ncn2)CC1)N1OCC[C@H]1c1cc(F)cc(F)c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 11/20 0.56
ATXN2 Q99700 1/20 0.33
FFAR4 Q5NUL3 2/20 0.31
PTGES O14684 1/20 0.31
HCRTR2 O43614 1/20 0.30
TBK1 Q9UHD2 1/20 0.30
KDM5A P29375 2/20 0.30
KDM2B Q8NHM5 2/20 0.30
KDM4C Q9H3R0 2/20 0.30
KDM5B Q9UGL1 2/20 0.30
ACACB O00763 1/20 0.30
KDM4A O75164 1/20 0.30

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
SCHEMBL31196111 1.00 RIPK1 (0.56) RIPK1ATXN2FFAR4PTGESHCRTR2
SCHEMBL31196507 0.89 RIPK1 (0.54) RIPK1
SCHEMBL31196108 0.89 RIPK1 (0.54) RIPK1
SCHEMBL31196130 0.88 RIPK1 (0.53) RIPK1TBK1ACACB
SCHEMBL31196316 0.88 RIPK1 (0.53) RIPK1TBK1ACACB
SCHEMBL31196232 0.86 RIPK1 (0.51) RIPK1FFAR4
SCHEMBL31196165 0.86 RIPK1 (0.51) RIPK1FFAR4
SCHEMBL31196372 0.84 RIPK1 (0.51) RIPK1
SCHEMBL31196298 0.84 RIPK1 (0.51) RIPK1
SCHEMBL31196431 0.78 RIPK1 (0.55) RIPK1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4709716-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF GENZYME CORPORATION (US) 2026-03-18 EP claimed
WO-2024233554-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF GENZYME CORPORATION (US) 2024-11-14 WO claimed
EP-4709716-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF GENZYME CORPORATION (US) 2026-03-18 EP disclosed
WO-2024233554-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF GENZYME CORPORATION (US) 2024-11-14 WO disclosed