SCHEMBL21207962

SCHEMBL21207962

CC(C)=C(NO)N/N=C(\C)c1ccc(NC(=O)Nc2ccc(/C(C)=N/N/C(N)=N/O)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 5/20 0.46
▸ MGLL Q99685 4/20 0.44
▸ BCHE P06276 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MAPT P10636 1/20 0.42

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
SCHEMBL13941537 0.90 FAAH (0.51) FAAHMGLLBCHE
SCHEMBL23818373 0.89 FAAH (0.51) FAAHMGLLBCHEMEN1KMT2A
SCHEMBL15597354 0.85 FAAH (0.46) FAAHMGLLBCHEMEN1KMT2A
SCHEMBL20811742 0.81 FAAH (0.44) FAAHMGLLBCHE
SCHEMBL20327258 0.79 FAAH (0.40) FAAHMGLLBCHEMEN1KMT2A
SCHEMBL24529020 0.75 FAAH (0.37) FAAHMGLLBCHEMEN1KMT2A
SCHEMBL13160507 0.74 PLK4 (0.57) FAAHMGLLBCHE
SCHEMBL13941402 0.74 PLK4 (0.57) FAAHMGLLBCHE
SCHEMBL13431057 0.74 PLK4 (0.57) FAAHMGLLBCHE
SCHEMBL21697211 0.72 F7 (0.42) FAAHMGLLBCHE

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
WO-2019148055-A9 IMIDE-BASED MODULATORS OF PROTEOLYSIS AND METHODS OF USE YALE UNIVERSITY (US) 2019-09-26 — — WO disclosed
WO-2019148055-A1 IMIDE-BASED MODULATORS OF PROTEOLYSIS AND METHODS OF USE YALE UNIVERSITY (US) 2019-08-01 — — WO disclosed
Send feedback