SCHEMBL27831055

SCHEMBL27831055

[CH2]C(O)(c1ccccc1Cl)N1CCN(C)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ DRD3 P35462 1/20 0.39
▸ CCR6 P51684 1/20 0.37
▸ ADRA1A P35348 2/20 0.37
▸ ADRA2A P08913 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ ADRA2B P18089 1/20 0.37
▸ ADRA2C P18825 1/20 0.37
▸ ADRA1D P25100 1/20 0.37
▸ ADRA1B P35368 1/20 0.37
▸ HRH4 Q9H3N8 3/20 0.36
▸ HTR3B O95264 1/20 0.36
▸ HTR3A P46098 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ MC4R P32245 1/20 0.35
▸ BCL2A1 Q16548 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ POLB P06746 1/20 0.34

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
SCHEMBL27951857 0.85 KCNN4 (0.35) KMT2AADRA1ANPSR1POLBHTR2A
SCHEMBL27810568 0.81 ADRB1 (0.46) DRD2DRD3CYP2D6HTR3BHTR3A
SCHEMBL27831041 0.75 HTT (0.44) KMT2AHRH4NPSR1HTT
SCHEMBL27546772 0.68 KCNN4 (0.45) KMT2ADRD2DRD3ADRA1AADRA2A
SCHEMBL11763806 0.66 KMT2A (0.41) KMT2ADRD2DRD3HRH4USP2
SCHEMBL27939611 0.65 ALDH1A1 (0.36) KMT2ACCR6NPSR1POLB
SCHEMBL8895713 0.64 KCNN4 (0.45) KMT2AADRA1ACYP2D6HTR2AHTR2C
SCHEMBL30530487 0.64 KCNN4 (0.45) KMT2AADRA1ACYP2D6HTR2AHTR2C
SCHEMBL3092500 0.64 KCNN4 (0.45) KMT2ADRD2DRD3ADRA1AADRA2A
SCHEMBL4298643 0.64 KCNN4 (0.45) KMT2AADRA1ACYP2D6HTR2AHTR2C

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
CN-102093319-B 3-aryl-4-(2-glycosyl/amino ethyoxyl)-2(5H)-furanone compound, preparation method thereof and application thereof UNIV JISHOU 2013-01-23 — — CN disclosed
CN-102093319-A 3-aryl-4-(2-glycosyl/amino ethyoxyl)-2(5H)-furanone compound, preparation method thereof and application thereof UNIV JISHOU 2011-06-15 — — CN disclosed
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