SCHEMBL7410488

SCHEMBL7410488

O=c1[nH]c(CCCCCl)nc2ccccc12

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 4/20 0.71
PDE10A Q9Y233 3/20 0.64
PARP2 Q9UGN5 1/20 0.62
TNKS2 Q9H2K2 1/20 0.60
KMT2A Q03164 1/20 0.59
RAB9A P51151 2/20 0.58
HTR1A P08908 4/20 0.58
HTR7 P34969 4/20 0.58
KDM4E B2RXH2 1/20 0.56
LMNA P02545 1/20 0.56
MAPT P10636 1/20 0.56
HCAR2 Q8TDS4 3/20 0.56
NPC1 O15118 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56

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
SCHEMBL7526687 0.89 PDE10A (0.69) PARP1PDE10APARP2TNKS2KMT2A
SCHEMBL30176852 0.86 PARP1 (0.73) PARP1PDE10APARP2TNKS2KMT2A
SCHEMBL16404338 0.85 PDE10A (0.84) PARP1PDE10APARP2TNKS2KMT2A
SCHEMBL1586541 0.85 PARP1 (0.91) PARP1PDE10APARP2TNKS2KMT2A
SCHEMBL30176973 0.84 PARP1 (0.89) PARP1PDE10APARP2TNKS2KMT2A
SCHEMBL6795539 0.84 PARP1 (0.69) PARP1PDE10APARP2TNKS2KMT2A
SCHEMBL4852668 0.84 PARP1 (0.69) PARP1PDE10APARP2TNKS2KMT2A
SCHEMBL30176861 0.84 PARP1 (0.89) PARP1PDE10APARP2TNKS2KMT2A
SCHEMBL22857122 0.84 PARP1 (0.89) PARP1PDE10APARP2TNKS2KMT2A
SCHEMBL14621928 0.84 PARP1 (0.89) PARP1PDE10APARP2TNKS2KMT2A

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-1200072-A2 METHOD OF TREATING PSYCHOTIC DISORDERS Solvay Pharmaceuticals B.V. (NL) 2002-05-02 EP disclosed
WO-2000069424-A2 METHOD OF TREATING PSYCHOTIC DISORDERS SOLVAY PHARMACEUTICALS B.V. (NL) 2000-11-23 WO disclosed