SCHEMBL9263247

SCHEMBL9263247

O=C(CCN1CCc2ccccc2C1)NC(=O)c1ccc(C=c2[nH]c(=O)c(=Cc3ccccc3)[nH]c2=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 6/20 0.59
WDR77 Q9BQA1 6/20 0.59
HDAC3 O15379 2/20 0.51
HDAC1 Q13547 2/20 0.51
HDAC8 Q9BY41 2/20 0.51
NCOR2 Q9Y618 2/20 0.51
KDM4E B2RXH2 2/20 0.51
ALOX15 P16050 1/20 0.51
DRD2 P14416 3/20 0.46
DRD3 P35462 3/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
USP2 O75604 1/20 0.45
TAAR1 Q96RJ0 1/20 0.45

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
SCHEMBL9263228 1.00 PRMT5 (0.59) PRMT5WDR77HDAC3HDAC1HDAC8
SCHEMBL8425898 0.87 DRD2 (0.57) PRMT5WDR77KDM4EDRD2DRD3
SCHEMBL8425893 0.87 DRD2 (0.57) PRMT5WDR77KDM4EDRD2DRD3
SCHEMBL8426178 0.85 DRD2 (0.63) PRMT5WDR77KDM4EDRD2DRD3
SCHEMBL8426184 0.85 DRD2 (0.63) PRMT5WDR77KDM4EDRD2DRD3
SCHEMBL8426019 0.84 DRD3 (0.67) PRMT5WDR77DRD2DRD3HTR1A
SCHEMBL8426018 0.84 DRD3 (0.67) PRMT5WDR77DRD2DRD3HTR1A
SCHEMBL8333005 0.77 DRD2 (0.50) PRMT5WDR77KDM4EALOX15DRD2
SCHEMBL8333009 0.77 DRD2 (0.50) PRMT5WDR77KDM4EALOX15DRD2
SCHEMBL8425003 0.76 ABCG2 (0.78) KDM4EMEN1KMT2ASMN1; SMN2ABCB1

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
WO-1995021832-A1 PHARMACEUTICAL PIPERAZINE COMPOUNDS XENOVA LIMITED (GB) 1995-08-17 WO claimed