SCHEMBL18507445

SCHEMBL18507445

CCc1cc(Cc2cc(CC)c(N3C(=O)C=CC3=O)c(CC)c2)cc(CC)c1N

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 8/20 0.40
FAAH O00519 2/20 0.38
HTT P42858 2/20 0.36
POLB P06746 1/20 0.36
DHFR P00374 2/20 0.32
HSP90AA1 P07900 1/20 0.32
CCR6 P51684 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
GMNN O75496 1/20 0.31
LMNA P02545 1/20 0.31
THPO P40225 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL184980 0.91 MGLL (0.46) MGLLFAAHHTTHSP90AA1CCR6
SCHEMBL28297588 0.87 MGLL (0.40) MGLLFAAHHSP90AA1CCR6ALDH1A1
SCHEMBL12586509 0.85 MGLL (0.41) MGLLFAAHHTTHSP90AA1CCR6
SCHEMBL15902670 0.82 MGLL (0.52) MGLLFAAHHTTHSP90AA1CCR6
SCHEMBL23484427 0.82 MGLL (0.39) MGLLFAAHHSP90AA1CCR6ALDH1A1
SCHEMBL184912 0.81 MGLL (0.41) MGLLFAAHHTTDHFRHSP90AA1
SCHEMBL29649706 0.81 MGLL (0.41) MGLLFAAHHTTDHFRHSP90AA1
SCHEMBL29386487 0.81 MGLL (0.41) MGLLFAAHHTTDHFRHSP90AA1
SCHEMBL30104190 0.80 MGLL (0.40) MGLLFAAHHSP90AA1CCR6ALDH1A1
SCHEMBL29306520 0.80 MGLL (0.40) MGLLFAAHHTTDHFRHSP90AA1

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-3187555-B1 MALEIMIDE FILM FURUKAWA ELECTRIC CO LTD (JP) 2023-08-23 EP disclosed
WO-2017027482-A1 ANIONIC CURABLE COMPOSITIONS DESIGNER MOLECULES, INC. (US) 2017-02-16 WO disclosed