SCHEMBL7200079

SCHEMBL7200079

FC(F)(F)c1ccc(Cl)c(CN2CC(C(c3ccccc3)c3ccccc3)N3CCC[C@H]3C2)c1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.44
SLC6A4 P31645 2/20 0.36
SLC6A2 P23975 1/20 0.36
DCUN1D1 Q96GG9 1/20 0.36
S1PR1 P21453 2/20 0.36
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL6541058 1.00 FFAR1 (0.44) FFAR1SLC6A4SLC6A2DCUN1D1S1PR1
SCHEMBL7200082 1.00 FFAR1 (0.44) FFAR1SLC6A4SLC6A2DCUN1D1S1PR1
SCHEMBL7199957 0.89 FFAR1 (0.39) FFAR1DCUN1D1KMT2A
SCHEMBL7199952 0.89 FFAR1 (0.39) FFAR1DCUN1D1KMT2A
SCHEMBL6540459 0.89 FFAR1 (0.39) FFAR1DCUN1D1KMT2A
SCHEMBL6540421 0.89 FFAR1 (0.47) FFAR1
Hydrochloric Acid SCHEMBL6540472 0.85 TACR1 (0.47) FFAR1MEN1KMT2A
SCHEMBL6541644 0.83 TACR1 (0.44)
SCHEMBL7196051 0.81 ALDH1A1 (0.51) MEN1GAAKMT2A
SCHEMBL7196054 0.81 ALDH1A1 (0.51) MEN1GAAKMT2A

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
EP-1294700-A2 BENZHYDRYL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-26 EP disclosed
WO-2002000631-A2 BENZHYDRYL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-03 WO disclosed