SCHEMBL25986948

SCHEMBL25986948

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

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ TLR7 Q9NYK1 1/20 0.30
▸ CARM1 Q86X55 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ THRB P10828 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
SCHEMBL26022857 0.87 KRAS (0.33) CARM1
SCHEMBL25938420 0.86 BTK (0.33) CARM1
SCHEMBL25988966 0.85 MEN1 (0.39) —
SCHEMBL27120419 0.85 S1PR1 (0.31) —
SCHEMBL25986054 0.77 — —
SCHEMBL25993969 0.77 SLC6A2 (0.36) —
SCHEMBL27006159 0.76 SDCBP (0.37) NPC1RAB9AMAPTTHRB
SCHEMBL25997931 0.75 KRAS (0.36) NPC1RAB9AMAPT
SCHEMBL25993613 0.71 TLR7 (0.32) NPC1RAB9AATMTLR7CYP2D6
SCHEMBL26418968 0.71 HRH3 (0.49) NPC1RAB9AATMTLR7CYP2D6

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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