SCHEMBL25997931

SCHEMBL25997931

C=CCCC(C(=O)NC)N1CCc2ccc(C)cc2C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KRAS P01116 1/20 0.36
▸ SLC6A2 P23975 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ AKR1C3 P42330 1/20 0.35
▸ NAMPT P43490 1/20 0.35
▸ PRMT5 O14744 1/20 0.34
▸ WDR77 Q9BQA1 1/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ DPP8 Q6V1X1 2/20 0.34
▸ DPP9 Q86TI2 2/20 0.34
▸ NOTUM Q6P988 1/20 0.34
▸ DPP7 Q9UHL4 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ HTR2C P28335 1/20 0.33

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
SCHEMBL26003508 0.90 AKR1C3 (0.35) KRASAKR1C3NAMPTPRMT5WDR77
SCHEMBL26022857 0.88 KRAS (0.33) KRASSLC6A2SLC6A3AKR1C3DPP8
SCHEMBL27113705 0.81 MMP1 (0.33) DPP9
SCHEMBL27122248 0.79 HRH3 (0.40) MEN1KMT2A
SCHEMBL25938420 0.78 BTK (0.33) —
SCHEMBL19370918 0.78 SCN9A (0.39) AKR1C3NAMPTNOTUMHTR2AHTR2C
SCHEMBL25993223 0.76 THRB (0.33) SLC6A2SLC6A3NAMPT
SCHEMBL26020707 0.76 THRB (0.43) MAPT
SCHEMBL25986948 0.75 NPC1 (0.31) MAPTRAB9ANPC1
SCHEMBL19370702 0.75 ESR2 (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 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
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