SCHEMBL5526293

SCHEMBL5526293

CC(=CC1CC2CCC1(C)C2(C)C)C(=O)OC1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.38
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C19 P33261 1/20 0.36
ELANE P08246 1/20 0.35
GAA P10253 2/20 0.34
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
KDM4E B2RXH2 1/20 0.34
XBP1 P17861 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL29272738 0.83 EPHX2 (0.39) LMNAKMT2AMEN1ALDH1A1MAPT
SCHEMBL28419534 0.80 ALDH1A1 (0.36) LMNAKMT2AALDH1A1MAPTMAPK1
Maleic Acid SCHEMBL3906942 0.79 CYP2C19 (0.39) LMNAKMT2AMEN1ALDH1A1MAPT
SCHEMBL9418339 0.79 MEN1 (0.34) LMNAKMT2AMEN1ALDH1A1CYP2C19
SCHEMBL2029635 0.79 KMT2A (0.39) LMNAKMT2AMEN1ALDH1A1MAPT
SCHEMBL21799353 0.79 KMT2A (0.39) LMNAKMT2AMEN1ALDH1A1MAPT
SCHEMBL17745706 0.79 KMT2A (0.39) LMNAKMT2AMEN1ALDH1A1MAPT
SCHEMBL26529 0.79 KMT2A (0.39) LMNAKMT2AMEN1ALDH1A1MAPT
SCHEMBL20357288 0.79 KMT2A (0.39) LMNAKMT2AMEN1ALDH1A1MAPT
SCHEMBL27175899 0.78 CYP2C19 (0.36) LMNAKMT2AALDH1A1MAPTMAPK1

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-20070254231-A1 Toner for Electrophotography KYOCERA MITA CORPORATION (JP) 2007-11-01 US claimed
US-20070254231-A1 Toner for Electrophotography KYOCERA MITA CORPORATION (JP) 2007-11-01 US disclosed