SCHEMBL7754502

SCHEMBL7754502

COC1CCC(N(Cc2ccccc2)C[C@H](O)COc2ccccc2)Cc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
PRMT5 O14744 3/20 0.44
WDR77 Q9BQA1 3/20 0.44
ADRB3 P13945 1/20 0.43
ALDH1A1 P00352 3/20 0.40
DRD2 P14416 2/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 2/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
DRD4 P21917 2/20 0.37
DRD3 P35462 1/20 0.37
LMNA P02545 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL5146452 0.81 PRMT5 (0.48) POLBPRMT5WDR77ADRB3ALDH1A1
SCHEMBL5141951 0.77 DRD2 (0.60) POLBPRMT5WDR77ALDH1A1DRD2
SCHEMBL5143855 0.77 PRMT5 (0.47) POLBPRMT5WDR77ADRB3ALDH1A1
SCHEMBL5143959 0.76 ALDH1A1 (0.48) POLBPRMT5WDR77ADRB3ALDH1A1
SCHEMBL5143652 0.76 ALDH1A1 (0.48) POLBPRMT5WDR77ADRB3ALDH1A1
SCHEMBL7570285 0.76 NPSR1 (0.48) POLBPRMT5WDR77ADRB3DRD2
Hydrochloric Acid SCHEMBL5145557 0.75 DRD2 (0.52) POLBPRMT5WDR77ALDH1A1DRD2
SCHEMBL5144057 0.74 DRD2 (0.48) POLBPRMT5WDR77ADRB3ALDH1A1
SCHEMBL5146546 0.74 PRMT5 (0.46) POLBPRMT5WDR77ADRB3ALDH1A1
SCHEMBL5146499 0.74 PRMT5 (0.48) POLBPRMT5WDR77ADRB3ALDH1A1

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-1070046-A1 PROPANOLAMINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-01-24 EP disclosed
WO-1999051564-A1 PROPANOLAMINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-10-14 WO disclosed