SCHEMBL4010756

SCHEMBL4010756

CCOc1cccc(F)c1Oc1ncccc1C1CCN(C(=O)O)CC1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 8/20 0.55
SLC6A2 P23975 8/20 0.55
SLC6A4 P31645 8/20 0.55
SLC6A3 Q01959 3/20 0.55
CHRM4 P08173 1/20 0.42
CHRM1 P11229 1/20 0.42

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
SCHEMBL4004752 0.90 HTR1A (0.68) HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL4007230 0.89 HTR1A (0.63) HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL4007303 0.87 HTR1A (0.49) HTR1ASLC6A2SLC6A4SLC6A3CHRM4
SCHEMBL4008152 0.86 HTR1A (0.67) HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL4007428 0.86 HTR1A (0.65) HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL4008285 0.86 HTR1A (0.64) HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL4013639 0.84 HTR1A (0.67) HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL4014127 0.82 SMN1; SMN2 (0.50) HTR1ASLC6A2
Trifluoroacetic Acid SCHEMBL4008507 0.82 HTR1A (0.68) HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL13770273 0.82 HTR1A (0.80) HTR1ASLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009081259-A1 PHENOXY-PYRIDYL DERIVATIVES PFIZER INC. (US) 2009-07-02 WO disclosed