SCHEMBL31196325

SCHEMBL31196325

COC(=O)C1CCCC(COc2cc(Cl)ncn2)CC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.40
CNR2 P34972 8/20 0.38
LMNA P02545 1/20 0.37
ACACB O00763 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
KMO O15229 1/20 0.35

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
SCHEMBL31196433 0.85 HPGD (0.40) HPGDCNR2ACACB
SCHEMBL22247294 0.80 KMO (0.40) CNR2ACACBMEN1KMT2AKMO
SCHEMBL31196319 0.76 KMT2A (0.42) HPGDLMNASMN1; SMN2MEN1KMT2A
SCHEMBL31196334 0.71 PARP10 (0.41) CNR2KMO
SCHEMBL2705546 0.71 FFAR4 (0.39) CNR2ACACBMEN1KMT2AKMO
SCHEMBL25194853 0.69 LMNA (0.65) LMNASMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL2704510 0.69 SLC6A4 (0.35) CNR2ACACB
SCHEMBL31038214 0.69 LMNA (0.65) LMNASMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL31196542 0.68 ALDH1A1 (0.45) HPGDSMN1; SMN2KMT2AL3MBTL1
SCHEMBL15114932 0.67 CDK2 (0.41)

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 2 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 disclosed
WO-2024233554-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF GENZYME CORPORATION (US) 2024-11-14 WO disclosed