SCHEMBL24969871

SCHEMBL24969871

O=C(N1CCN(Cc2cccc(C(F)(F)F)c2N2CCCC2)CC1)n1ccc(C(O)O)n1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.64
MGLL Q99685 5/20 0.42
PLA2G7 Q13093 2/20 0.42
ABHD6 Q9BV23 2/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALOX15 P16050 2/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TSHR P16473 2/20 0.39
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL25644268 0.92 FAAH (0.77) FAAHMGLLPLA2G7ABHD6ALDH1A1
SCHEMBL20566520 0.86 FAAH (0.85) FAAHMGLL
SCHEMBL30420513 0.86 FAAH (0.85) FAAHMGLL
SCHEMBL25841535 0.80 FAAH (0.75) FAAHMGLLPLA2G7ABHD6
SCHEMBL30420360 0.78 FAAH (1.00) FAAHMGLLPLA2G7ABHD6
SCHEMBL20567315 0.78 FAAH (1.00) FAAHMGLLPLA2G7ABHD6
SCHEMBL20567116 0.78 FAAH (1.00) FAAHMGLLPLA2G7ABHD6
SCHEMBL30420358 0.78 FAAH (1.00) FAAHMGLLPLA2G7ABHD6
SCHEMBL25644308 0.75 FAAH (0.54) FAAHMGLL
SCHEMBL21271389 0.74 FAAH (0.59) FAAHMGLLALDH1A1KDM4EMEN1

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-3630744-B1 PYRAZOLE MAGL INHIBITORS H LUNDBECK AS (DK) 2023-01-25 EP disclosed