SCHEMBL18643159

SCHEMBL18643159

O=C1CC(C2CCCC2)C(=O)N1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 1/20 0.48
MAPT P10636 2/20 0.41
CRBN Q96SW2 1/20 0.36
CYP19A1 P11511 1/20 0.33
MEN1 O00255 1/20 0.33
APEX1 P27695 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
IDO1 P14902 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
SCHEMBL11719476 0.98 MAP3K14 (0.46) MAP3K14MAPTCRBNCYP19A1MEN1
SCHEMBL11384813 0.84 MAP3K14 (0.52) MAP3K14MAPTCRBNCYP19A1MEN1
SCHEMBL11384807 0.84 MAP3K14 (0.52) MAP3K14MAPTCRBNCYP19A1MEN1
SCHEMBL5909391 0.80 MAP3K14 (0.55) MAP3K14MAPTCRBNCYP19A1MEN1
SCHEMBL5556075 0.78 MAP3K14 (0.41) MAP3K14CRBN
Bicarbonate SCHEMBL28708130 0.78 MAP3K14 (0.34) MAP3K14MEN1APEX1KMT2ATDP1
SCHEMBL18261248 0.72 MAP3K14 (0.35) MAP3K14
SCHEMBL9484357 0.72 MAP3K14 (0.35) MAP3K14CRBN
SCHEMBL9998408 0.72 MAP3K14 (0.35) MAP3K14
SCHEMBL28541981 0.71 MAP3K14 (0.46) MAP3K14MAPTCRBNKMT2AALDH1A1

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-2793928-B1 PROCESS FOR PURIFYING A SAMPLE OF H38C2 ANTIBODY PFIZER (US) 2017-03-15 EP disclosed