SCHEMBL7957074

SCHEMBL7957074

NNC(=O)CCCN1CCC(c2cccc3ccccc23)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.58
SLC6A4 P31645 1/20 0.58
HRH3 Q9Y5N1 1/20 0.51
HTR1D P28221 1/20 0.50
HTR1B P28222 1/20 0.50
DRD4 P21917 3/20 0.44
LMNA P02545 1/20 0.44
KMT2A Q03164 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
NCOR2 Q9Y618 1/20 0.43
HTR7 P34969 4/20 0.42
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
BCHE P06276 1/20 0.41
HTR2A P28223 1/20 0.41
DRD3 P35462 1/20 0.41
KDM4E B2RXH2 2/20 0.41

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
SCHEMBL7957585 0.83 KMT2A (0.48) DRD2LMNAKMT2APOLBHTT
SCHEMBL7957071 0.82 DRD2 (0.54) DRD2SLC6A4HRH3HTR1DHTR1B
SCHEMBL7949576 0.81 DRD2 (0.48) DRD2DRD4LMNAKMT2APOLB
SCHEMBL7067307 0.80 DRD2 (0.60) DRD2SLC6A4HRH3HTR1DHTR1B
SCHEMBL9032338 0.80 SLC6A4 (0.70) DRD2SLC6A4HRH3HTR1DHTR1B
SCHEMBL7960244 0.80 DRD2 (0.62) DRD2SLC6A4HRH3HTR1DHTR1B
SCHEMBL7961377 0.79 DRD2 (0.58) DRD2SLC6A4HRH3DRD4KMT2A
SCHEMBL6710735 0.79 SLC6A4 (0.68) DRD2SLC6A4HRH3HTR1DHTR1B
SCHEMBL6788939 0.78 DRD2 (0.50) DRD2SLC6A4HRH3HTR1DHTR1B
SCHEMBL9323878 0.77 SLC6A4 (0.74) DRD2SLC6A4HRH3HTR1DHTR1B

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-6187774-B1 N-PIPERAZINYLALKYLINDAZOLE DERIVATIVES; PSYCHOLOGICAL DISORDERS, SCHIZOPHRENIA; SIDE EFFECT REDUCTION YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2001-02-13 US disclosed
EP-0885883-A1 FUSED HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL APPLICATIONS THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1998-12-23 EP disclosed