SCHEMBL9615241

SCHEMBL9615241

CCOC(=O)C(=C(C)C)C(CC)(CC)C(=O)OCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TSHR P16473 3/20 0.39
GLO1 Q04760 1/20 0.38
ALDH1A1 P00352 4/20 0.38
LMNA P02545 2/20 0.38
HSD17B10 Q99714 1/20 0.38
PKM P14618 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
CYP1A2 P05177 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
CYP4F2 P78329 2/20 0.37
CYP4A11 Q02928 2/20 0.37
THRB P10828 1/20 0.37
HTT P42858 1/20 0.36
MAPT P10636 2/20 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
SCHEMBL13269576 0.85 GLO1 (0.38) MEN1KMT2ATSHRGLO1ALDH1A1
SCHEMBL13269273 0.79 GLO1 (0.34) MEN1KMT2ATSHRGLO1ALDH1A1
SCHEMBL1244565 0.79 MEN1 (0.54) MEN1KMT2ATSHRALDH1A1LMNA
SCHEMBL1728132 0.77 MEN1 (0.48) MEN1KMT2ATSHRALDH1A1LMNA
SCHEMBL23091475 0.77 MEN1 (0.52) MEN1KMT2ATSHRALDH1A1LMNA
Iodide SCHEMBL10533617 0.77 MEN1 (0.52) MEN1KMT2ATSHRALDH1A1LMNA
SCHEMBL27889245 0.77 MEN1 (0.52) MEN1KMT2ATSHRALDH1A1LMNA
Ammonia Solution, Strong SCHEMBL29049233 0.77 MEN1 (0.52) MEN1KMT2ATSHRALDH1A1LMNA
SCHEMBL13269461 0.76 MMP8 (0.36) GLO1ALDH1A1LMNAHSD17B10MAPT
SCHEMBL1818399 0.75 MEN1 (0.47) MEN1KMT2ATSHRALDH1A1LMNA

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
JP-4128281-A None JP disclosed
JP-H04128281-A PHOTOCHROMIC COMPOUND YAMAHA CORP 1992-04-28 JP disclosed