SCHEMBL22053358

SCHEMBL22053358

FC(F)(F)c1ccc([C@H]2CNCCO2)cc1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.68

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
SCHEMBL1760973 1.00 HTR1A (0.68) HTR1A
Oxalic Acid SCHEMBL12520684 0.91 HTR1A (0.59) HTR1A
SCHEMBL1987896 0.85
SCHEMBL1993124 0.85
SCHEMBL1987897 0.85
Hydrochloric Acid SCHEMBL1998920 0.84 SLC6A3 (0.60)
Hydrochloric Acid SCHEMBL1996273 0.84 SLC6A3 (0.60)
SCHEMBL12609760 0.84
Hydrochloric Acid SCHEMBL1994945 0.84 SLC6A3 (0.60)
SCHEMBL12609755 0.84

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-2020107189-A1 PYRROLIDINE COMPOUNDS FOR THE TREATMENT OF MALARIA LEGION PHARMA CO. LTD (CN) 2020-06-04 WO disclosed