SCHEMBL4748304

SCHEMBL4748304

OC(CCc1cc(F)ccc1F)CN1CCc2ccccc2C1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 16/20 0.58
KDM4E B2RXH2 1/20 0.57
MAPK1 P28482 1/20 0.57
HTT P42858 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
WDR77 Q9BQA1 11/20 0.54
CARM1 Q86X55 1/20 0.51
HTR1A P08908 1/20 0.49
DRD2 P14416 1/20 0.49
HTR7 P34969 1/20 0.49

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
SCHEMBL496566 0.80 PRMT5 (0.51) PRMT5KDM4EMAPK1HTTNPSR1
Hydrochloric Acid SCHEMBL496305 0.79 PRMT5 (0.50) PRMT5KDM4EMAPK1HTTNPSR1
SCHEMBL17578645 0.77 CARM1 (0.63) PRMT5HTTWDR77CARM1
SCHEMBL30019323 0.76 CARM1 (0.74) PRMT5HTTWDR77CARM1
SCHEMBL20042490 0.74 CARM1 (0.71) PRMT5KDM4EMAPK1HTTNPSR1
SCHEMBL25910580 0.74 CARM1 (0.71) PRMT5KDM4EMAPK1HTTNPSR1
SCHEMBL13875133 0.74 CARM1 (0.71) PRMT5KDM4EMAPK1HTTNPSR1
SCHEMBL17813632 0.72 CARM1 (0.68) PRMT5HTTWDR77CARM1
SCHEMBL13033223 0.72 PRMT5 (0.78) PRMT5WDR77
SCHEMBL21351057 0.72 PRMT5 (0.72) PRMT5WDR77

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-1910317-A1 1-AMINO LINKED COMPOUNDS Eli Lilly and Company (US) 2008-04-16 EP disclosed
WO-2007015805-A1 1-AMINO LINKED COMPOUNDS ELI LILLY AND COMPANY (US) 2007-02-08 WO disclosed