SCHEMBL19389962

SCHEMBL19389962

Fc1ccc(OCCN2CCC(F)(F)C2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.57
▸ HRH3 Q9Y5N1 3/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ USP2 O75604 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ DRD2 P14416 4/20 0.48
▸ HTR1A P08908 2/20 0.48
▸ HTR2A P28223 2/20 0.48
▸ HRH1 P35367 2/20 0.48
▸ DRD3 P35462 2/20 0.48
▸ DRD1 P21728 1/20 0.48
▸ DRD5 P21918 1/20 0.48
▸ SLC6A2 P23975 1/20 0.48
▸ SLC6A4 P31645 1/20 0.48
▸ HTR7 P34969 1/20 0.48
▸ HTR2B P41595 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
SCHEMBL12321327 0.87 GRIN2D (0.53) HRH3DRD2SLC6A4PSMB1PSMB5
SCHEMBL12278101 0.84 KMT2A (0.56) LTA4HHRH3MEN1HTTKMT2A
SCHEMBL23291189 0.82 HRH3 (0.49) LTA4HHRH3DRD2PSMB1PSMB5
SCHEMBL1730306 0.80 LTA4H (0.77) LTA4HHRH3MEN1LMNAHTT
SCHEMBL25381352 0.80 TBXAS1 (0.48) LTA4HHRH3HTTDRD2HRH1
SCHEMBL13290237 0.80 MCHR1 (0.75) HRH3MCHR1
SCHEMBL22137693 0.77 LTA4H (0.63) LTA4HHRH3HTR1AHTR7MCHR1
SCHEMBL82404 0.77 HRH3 (0.59) LTA4HHRH3ALDH1A1DRD2PSMB1
SCHEMBL9199004 0.77 HRH3 (0.60) LTA4HHRH3MEN1LMNAHTT
SCHEMBL17198029 0.76 LTA4H (0.59) LTA4HHRH3DRD2TMEM97SIGMAR1

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
EP-3083562-B1 PHENOXYETHYL CYCLIC AMINE DERIVATIVES AND THEIR ACTIVITY AS EP4 RECEPTOR MODULATORS LILLY CO ELI (US) 2017-09-27 — — EP disclosed
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