SCHEMBL13829324

SCHEMBL13829324

CCC(C)(C)C(=O)OCC12CC3CC(C)(CC(O)(C3)C1)C2

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
SCN9A Q15858 1/20 0.31
EPHX2 P34913 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
SCHEMBL9924488 0.92 ALDH1A1 (0.36) MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL14489096 0.88 GRIN2D (0.38) MEN1KMT2AGRIN2DGRIN3BGRIN1
SCHEMBL9924497 0.87 ALDH1A1 (0.33) MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL14707478 0.86 MEN1 (0.36) MEN1KMT2AGRIN2DGRIN3BGRIN1
SCHEMBL9924481 0.83 ALDH1A1 (0.41) MEN1KMT2AALDH1A1L3MBTL1SCN9A
SCHEMBL10225067 0.81 SCN9A (0.35) MEN1KMT2AGRIN2DGRIN3BGRIN1
SCHEMBL12346467 0.80 ALDH1A1 (0.33) MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL9924498 0.80 ALDH1A1 (0.37) MEN1KMT2AGRIN2DGRIN3BGRIN1
SCHEMBL18845367 0.79 ALDH1A1 (0.35) MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL677102 0.78 MEN1 (0.36) MEN1KMT2AGRIN2DGRIN3BGRIN1

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
US-20120288691-A1 PATTERN FORMING METHOD, PATTERN, CHEMICAL AMPLIFICATION RESIST COMPOSITION AND RESIST FILM FUJIFILM CORPORATION (JP) 2012-11-15 US disclosed