SCHEMBL26021674

SCHEMBL26021674

C=CCCC(C(=C)NC)N1Cc2cc(NC3CCCCC3)ccc2C1C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.33
▸ PTGS1 P23219 1/20 0.30
▸ PTGS2 P35354 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
SCHEMBL25999425 0.83 OPRK1 (0.30) —
SCHEMBL25993020 0.82 SLC6A2 (0.33) —
SCHEMBL25993969 0.80 SLC6A2 (0.36) —
SCHEMBL25937581 0.78 — —
SCHEMBL25938098 0.74 — —
SCHEMBL25994377 0.72 — —
SCHEMBL25994609 0.72 — —
SCHEMBL26000356 0.70 — —
SCHEMBL27119016 0.69 S1PR1 (0.31) —
SCHEMBL25939038 0.67 PTGS1 (0.31) PTGS1PTGS2

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
EP-3820573-B1 3-(5-HYDROXY-1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF IKAROS FAMILY ZINC FINGER 2 (IKZF2)-DEPENDENT DISEASES NOVARTIS AG (CH) 2023-08-09 — — EP disclosed
Send feedback