SCHEMBL19857048

SCHEMBL19857048

CC(CC(c1ccc(N2C(=O)C=CC2=O)cc1)c1ccc(N2C(=O)C=CC2=O)cc1)(c1ccc(Oc2ccc(N3C(=O)C=CC3=O)cc2)cc1)c1ccc(Oc2ccc(N3C(=O)C=CC3=O)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 15/20 0.54
HSP90AA1 P07900 3/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
HTT P42858 2/20 0.42
LMNA P02545 2/20 0.42
PKM P14618 2/20 0.42
MEN1 O00255 1/20 0.42
CCR6 P51684 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
FAAH O00519 5/20 0.40
NPSR1 Q6W5P4 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36
DDAH1 O94760 1/20 0.36
MAPK1 P28482 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
SCHEMBL486533 0.82 MGLL (0.57) MGLLHSP90AA1ALDH1A1HPGDHTT
SCHEMBL349905 0.80 MGLL (0.63) MGLLHSP90AA1ALDH1A1HPGDHTT
SCHEMBL94891 0.78 MGLL (0.64) MGLLHSP90AA1ALDH1A1HPGDHTT
SCHEMBL485546 0.78 MGLL (0.64) MGLLHSP90AA1ALDH1A1HPGDHTT
SCHEMBL15875894 0.78 MGLL (0.64) MGLLHSP90AA1ALDH1A1HPGDHTT
SCHEMBL28273833 0.78 MGLL (0.59) MGLLHSP90AA1ALDH1A1HPGDHTT
SCHEMBL9302232 0.76 MGLL (0.71) MGLLHSP90AA1ALDH1A1HPGDHTT
SCHEMBL25298886 0.76 MGLL (0.60) MGLLHSP90AA1ALDH1A1HPGDHTT
SCHEMBL28288548 0.76 MGLL (0.56) MGLLHSP90AA1ALDH1A1HPGDHTT
SCHEMBL1704669 0.75 MGLL (0.51) MGLLHSP90AA1ALDH1A1HPGDHTT

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-2778198-B1 RESIN COMPOSITION, AND PREPREG AND LAMINATED SHEET EACH PRODUCED USING SAME MITSUBISHI GAS CHEMICAL CO (JP) 2018-02-14 EP disclosed