SCHEMBL11645491

SCHEMBL11645491

O=C1CC([N]C2CC(=O)NC2=O)C(=O)N1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 1/20 0.48
CRBN Q96SW2 3/20 0.40
CYP19A1 P11511 1/20 0.36
KMT2A Q03164 2/20 0.33
IDO1 P14902 7/20 0.32
LMNA P02545 3/20 0.32
MAPT P10636 1/20 0.32
PKM P14618 1/20 0.32
MEN1 O00255 1/20 0.32
APEX1 P27695 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.31
DDB1 Q16531 1/20 0.31
GAA P10253 1/20 0.31
TSHR P16473 1/20 0.31
NPC1 O15118 1/20 0.30

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
SCHEMBL8342532 0.84
SCHEMBL11300738 0.77 MAP3K14 (0.41) MAP3K14CRBNCYP19A1
SCHEMBL31091776 0.77 MAP3K14 (0.41) MAP3K14CRBNCYP19A1LMNAALDH1A1
SCHEMBL4542045 0.75 MAP3K14 (0.40) MAP3K14CRBNCYP19A1
SCHEMBL5909391 0.69 MAP3K14 (0.55) MAP3K14CRBNCYP19A1KMT2AIDO1
SCHEMBL18475385 0.69 CRBN (0.46) MAP3K14CRBNTDP1ALDH1A1DDB1
Formic Acid SCHEMBL31232883 0.68 MAP3K14 (0.34) MAP3K14
SCHEMBL6897659 0.67
SCHEMBL23332645 0.65
SCHEMBL10053017 0.65

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
US-4116875-A Multifunctional substituted triazine functional fluid additives and compositions containing same MOBIL OIL CORPORATION (US) 1978-09-26 US disclosed
US-4113725-A PYRIMIDINE-PYRROLIDONE COMPOUND, DETERGENTS, ANTIOXIDANTS MOBIL OIL CORPORATION (US) 1978-09-12 US disclosed