SCHEMBL8916470

SCHEMBL8916470

O=C1NCCCc2cc(CCN3CCC(c4csc5cc(F)ccc45)CC3)sc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.37
SLC6A4 P31645 4/20 0.37
ADRA1D P25100 3/20 0.36
HTR2C P28335 3/20 0.36
HTR2A P28223 6/20 0.35
HTR1A P08908 4/20 0.35
CTSS P25774 2/20 0.35
DRD4 P21917 2/20 0.34
DRD1 P21728 2/20 0.34
DRD3 P35462 2/20 0.34
HTR6 P50406 2/20 0.34
SLC22A2 O15244 1/20 0.34
CACNA1F O60840 1/20 0.34
ADRB2 P07550 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
ADRA2A P08913 1/20 0.34
CYP2D6 P10635 1/20 0.34
CHRM1 P11229 1/20 0.34

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
SCHEMBL8916475 0.85 DRD2 (0.40) DRD2SLC6A4ADRA1DHTR2CHTR2A
SCHEMBL8919173 0.81 ACHE (0.58) DRD2SLC6A4ADRA1DHTR2CHTR2A
SCHEMBL8919063 0.77 DRD2 (0.40) DRD2SLC6A4HTR2AHTR1ADRD3
SCHEMBL8918049 0.77 DRD2 (0.42) DRD2SLC6A4ADRA1DHTR2CHTR2A
SCHEMBL8916845 0.75 DRD2 (0.39) DRD2SLC6A4HTR2AHTR1ADRD3
Bromide SCHEMBL7864959 0.69 DRD2 (0.47) DRD2SLC6A4HTR1ACTSSHTR6
SCHEMBL8918733 0.68 DRD2 (0.38) DRD2SLC6A4ADRA1DHTR2CHTR2A
SCHEMBL6897748 0.68 DRD2 (0.42) DRD2SLC6A4ADRA1DHTR2ACTSS
SCHEMBL8916437 0.68 DRD2 (0.59) DRD2SLC6A4ADRA1DHTR2CHTR2A
SCHEMBL8810833 0.67 DRD2 (0.43) DRD2SLC6A4ADRA1DHTR2CHTR2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US claimed
US-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US disclosed
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed