SCHEMBL5237364

SCHEMBL5237364

COc1ccc(-c2ccc(N3CCN(C(=O)O)CC3)cc2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.49
HTR1A P08908 2/20 0.48
HTR1D P28221 2/20 0.48
HTR1B P28222 2/20 0.48
HTR2A P28223 2/20 0.48
HTR2C P28335 1/20 0.48
HTR6 P50406 1/20 0.48
CD274 Q9NZQ7 1/20 0.47
LCK P06239 1/20 0.47
MAP4K3 Q8IVH8 1/20 0.47
MAP4K1 Q92918 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 3/20 0.46
SCD5 Q86SK9 1/20 0.46
GAA P10253 2/20 0.46
LMNA P02545 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL5238577 0.81 GRM5 (0.50) TP53HTR6MEN1KMT2AMAPT
SCHEMBL5239584 0.80 CD274 (0.45) TP53HTR1AHTR1DHTR1BHTR2A
SCHEMBL1581921 0.79 KDM4E (0.50) CD274MAPTLMNAHTTSMN1; SMN2
SCHEMBL8320029 0.79 ALK (0.55) MAPTGAALMNAL3MBTL1GFER
SCHEMBL5239166 0.79 ALDH1A1 (0.56) HTR1AHTR1DHTR1BMEN1KMT2A
SCHEMBL5234854 0.78 RAB9A (0.54) TP53MEN1KMT2AMAPTGAA
SCHEMBL5240923 0.78 RBP4 (0.56) HTR1AHTR1DHTR1BHTR2AHTR2C
SCHEMBL5237133 0.78 L3MBTL1 (0.49) TP53MEN1KMT2AMAPTL3MBTL1
SCHEMBL5237158 0.77 KMT2A (0.68) TP53MEN1KMT2AMAPTGAA
SCHEMBL3774486 0.76 ALDH1A1 (0.46) MEN1KMT2AMAPTGAALMNA

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-1701946-B1 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME SANOFI AVENTIS (FR) 2007-12-19 EP claimed