SCHEMBL8426019

SCHEMBL8426019

O=C(NCCCCN1CCc2ccccc2C1)c1ccc(C=c2[nH]c(=O)c(=Cc3ccccc3)[nH]c2=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 8/20 0.67
DRD2 P14416 6/20 0.67
DRD4 P21917 3/20 0.49
DRD1 P21728 2/20 0.49
LMNA P02545 1/20 0.49
TMEM97 Q5BJF2 1/20 0.49
SIGMAR1 Q99720 1/20 0.49
ACKR3 P25106 1/20 0.48
OPRM1 P35372 1/20 0.48
PRMT5 O14744 1/20 0.48
WDR77 Q9BQA1 1/20 0.48
HPGD P15428 1/20 0.46
HTR7 P34969 2/20 0.46
HTR1A P08908 1/20 0.46
HTR2A P28223 1/20 0.46
SLC6A4 P31645 1/20 0.46
HRH1 P35367 1/20 0.46
HTR2B P41595 1/20 0.46

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
SCHEMBL8426018 1.00 DRD3 (0.67) DRD3DRD2DRD4DRD1LMNA
SCHEMBL8426184 0.97 DRD2 (0.63) DRD3DRD2DRD4DRD1LMNA
SCHEMBL8426178 0.97 DRD2 (0.63) DRD3DRD2DRD4DRD1LMNA
SCHEMBL8425893 0.93 DRD2 (0.57) DRD3DRD2LMNATMEM97SIGMAR1
SCHEMBL8425898 0.93 DRD2 (0.57) DRD3DRD2LMNATMEM97SIGMAR1
SCHEMBL8428423 0.86 DRD3 (0.53) DRD3DRD2DRD4DRD1LMNA
SCHEMBL8428415 0.86 DRD3 (0.53) DRD3DRD2DRD4DRD1LMNA
SCHEMBL9263228 0.84 PRMT5 (0.59) DRD3DRD2PRMT5WDR77HTR7
SCHEMBL9263247 0.84 PRMT5 (0.59) DRD3DRD2PRMT5WDR77HTR7
SCHEMBL8333009 0.83 DRD2 (0.50) DRD3DRD2DRD4LMNASIGMAR1

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
US-5891877-A INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR XENOVA LIMITED (GB) 1999-04-06 US disclosed
WO-1995021832-A1 PHARMACEUTICAL PIPERAZINE COMPOUNDS XENOVA LIMITED (GB) 1995-08-17 WO disclosed