SCHEMBL20176853

SCHEMBL20176853

Cc1cc(F)c(OC2CNC2)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 11/20 0.49
HTR1A P08908 9/20 0.49
SLC6A4 P31645 4/20 0.49
SLC6A3 Q01959 4/20 0.43

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
SCHEMBL22837283 0.84 SLC6A2 (0.50) SLC6A2HTR1ASLC6A4SLC6A3
Hydrochloric Acid SCHEMBL20165483 0.82 SLC6A2 (0.49) SLC6A2HTR1ASLC6A4SLC6A3
SCHEMBL2299895 0.81 SLC6A2 (0.49) SLC6A2HTR1ASLC6A4SLC6A3
SCHEMBL20425165 0.81 SLC6A2 (0.47) SLC6A2HTR1ASLC6A4SLC6A3
SCHEMBL20165891 0.77 SLC6A2 (0.47) SLC6A2HTR1ASLC6A4SLC6A3
SCHEMBL23255234 0.77 SLC6A4 (0.51) SLC6A2HTR1ASLC6A4SLC6A3
SCHEMBL20165474 0.76 SLC6A2 (0.74) SLC6A2HTR1ASLC6A4SLC6A3
SCHEMBL20165473 0.76 SLC6A2 (0.50) SLC6A2HTR1ASLC6A4SLC6A3
SCHEMBL17467925 0.75 POLB (0.42) SLC6A2HTR1ASLC6A4
Hydrochloric Acid SCHEMBL20165494 0.74 SLC6A2 (0.49) SLC6A2HTR1ASLC6A4SLC6A3

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-2018091687-A1 NOVEL AZETIDINE DERIVATIVES USEFUL AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION INTEGRATIVE RESEARCH LABORATORIES SWEDEN AB (SE) 2018-05-24 WO disclosed