SCHEMBL7098507

SCHEMBL7098507

Fc1ccc(OCC2CC[C@H]3CN(c4ncc(F)cn4)CCN3C2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 16/20 1.00
DRD2 P14416 15/20 1.00
HTR1A P08908 1/20 1.00
HTR2A P28223 1/20 1.00
SIGMAR1 Q99720 1/20 0.48

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
SCHEMBL14502883 1.00 DRD4 (1.00) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL8797434 1.00 DRD4 (1.00) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL6844226 1.00 DRD4 (1.00) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL5408639 1.00 DRD4 (1.00) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL5415647 1.00 DRD4 (1.00) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL14532740 1.00 DRD4 (1.00) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL5402861 1.00 DRD4 (1.00) DRD4DRD2HTR1AHTR2ASIGMAR1
SCHEMBL7558449 0.93 DRD4 (0.88) DRD4DRD2HTR1AHTR2A
SCHEMBL6905943 0.93 DRD4 (0.88) DRD4DRD2HTR1AHTR2A
SCHEMBL6843875 0.92 DRD4 (0.86) DRD4DRD2HTR1AHTR2A

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-20040116443-A1 Dopamine D4 ligands for the treatment of novelty-seeking disorders PFIZER INC 2004-06-17 US claimed
US-7220753-B2 2,7-substituted octahydro-1H-pyrido[1,2-a]pyrazine derivatives as ligands for serotonin receptors PFIZER INC. (US) 2007-05-22 US disclosed