SCHEMBL8916656

SCHEMBL8916656

O=C1NCCCc2sc(SCCCN3CCC(c4noc5cc(F)ccc45)CC3)cc21

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.58
ACHE P22303 2/20 0.53
HTR2C P28335 4/20 0.51
SLC6A4 P31645 1/20 0.50
HTR2A P28223 1/20 0.50

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
SCHEMBL8916790 0.89 ACHE (0.58) DRD2ACHEHTR2CSLC6A4HTR2A
SCHEMBL8917266 0.87 DRD2 (0.61) DRD2ACHEHTR2CSLC6A4HTR2A
SCHEMBL8916437 0.86 DRD2 (0.59) DRD2ACHEHTR2CSLC6A4HTR2A
SCHEMBL8917156 0.84 DRD2 (0.58) DRD2ACHEHTR2CHTR2A
SCHEMBL8920261 0.84 DRD2 (0.58) DRD2ACHEHTR2CSLC6A4HTR2A
SCHEMBL8917307 0.84 DRD2 (0.58) DRD2ACHEHTR2CSLC6A4HTR2A
SCHEMBL8918516 0.84 DRD2 (0.58) DRD2ACHEHTR2CSLC6A4HTR2A
SCHEMBL8917433 0.84 ACHE (0.54) DRD2ACHEHTR2CSLC6A4HTR2A
SCHEMBL8917294 0.82 ACHE (0.52) DRD2ACHEHTR2CSLC6A4HTR2A
SCHEMBL8916842 0.81 DRD2 (0.53) DRD2ACHEHTR2CSLC6A4HTR2A

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 disclosed
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed
EP-0596125-A1 CONDENSED THIOPHENE COMPOUND AND PHARMACEUTICAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-05-11 EP disclosed