SCHEMBL7812944

SCHEMBL7812944

Fc1ccc(OCC2CC3CN(c4ncc(F)cn4)CCN3C2)cc1

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 16/20 0.81
DRD2 P14416 15/20 0.81
HTR1A P08908 1/20 0.81
HTR2A P28223 1/20 0.81
SIGMAR1 Q99720 1/20 0.49

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
SCHEMBL6901918 1.00 DRD4 (0.81) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL7820625 0.92 DRD4 (0.69) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL7998001 0.91 DRD4 (0.69) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL6908454 0.91 DRD4 (0.69) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL7812210 0.91 DRD4 (0.69) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL14502883 0.90 DRD4 (1.00) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL6844226 0.90 DRD4 (1.00) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL5415647 0.90 DRD4 (1.00) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL5402861 0.90 DRD4 (1.00) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL7098507 0.90 DRD4 (1.00) DRD4DRD2HTR1AHTR2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0874849-B1 2,7-SUBSTITUTED OCTAHYDRO-PYRROLO 1,2-A]PYRAZINE DERIVATIVES PFIZER (US) 2001-09-19 EP disclosed
US-6284757-B1 ANTISEROTINONE AGENT PFIZER INC. 2001-09-04 US disclosed
EP-0982030-A2 2,7-substituted octahydro-pyrrolo 1,2-a]pyrazine derivatives as 5ht 1a ligands Pfizer Products Inc. (US) 2000-03-01 EP disclosed
EP-0874849-A1 2,7-SUBSTITUTED OCTAHYDRO-PYRROLO 1,2-A]PYRAZINE DERIVATIVES PFIZER INC. (US) 1998-11-04 EP disclosed
US-5714487-A 2,7-substituted octahydro-pyrrolo 1,2-a!pyrazine derivatives PFIZER INC. (US) 1998-02-03 US disclosed
WO-1997023482-A1 2,7-SUBSTITUTED OCTAHYDRO-PYRROLO[1,2-A]PYRAZINE DERIVATIVES PFIZER INC. (US) 1997-07-03 WO disclosed