SCHEMBL7958498

SCHEMBL7958498

C=C(C)C(=O)OC1CC2CCC1(C)C2(C)C.C=C(C=CC(=O)O)C(=O)OCCCC

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.46
HTT P42858 3/20 0.46
MAPT P10636 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
KDM4E B2RXH2 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
PLA2G1B P04054 1/20 0.42
MAPK1 P28482 1/20 0.42
RAD52 P43351 1/20 0.42
ATG4B Q9Y4P1 1/20 0.42
CYP2C19 P33261 1/20 0.41
CYP19A1 P11511 2/20 0.39
ALDH1A1 P00352 1/20 0.39
ELANE P08246 1/20 0.38

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
SCHEMBL7080412 0.88 LMNA (0.45) LMNAHTTMAPTNPSR1KDM4E
SCHEMBL7083081 0.88 LMNA (0.45) LMNAHTTMAPTNPSR1KDM4E
SCHEMBL7083311 0.88 LMNA (0.45) LMNAHTTMAPTNPSR1KDM4E
SCHEMBL7974389 0.88 LMNA (0.45) LMNAHTTMAPTNPSR1KDM4E
SCHEMBL28209309 0.87 LMNA (0.48) LMNAHTTMAPTNPSR1KDM4E
Butyl Fumarate SCHEMBL7805036 0.85 LMNA (0.41) LMNAHTTMAPTNPSR1KDM4E
SCHEMBL7974759 0.84 LMNA (0.48) LMNAHTTMAPTNPSR1KDM4E
Methacrylic Acid SCHEMBL1022891 0.83 LMNA (0.46) LMNAHTTMAPTNPSR1KDM4E
SCHEMBL3165671 0.83 CYP2C19 (0.52) LMNAMAPTKMT2AMAPK1CYP2C19
Acrylic Acid SCHEMBL2129070 0.83 CYP2C19 (0.40) LMNAHTTMAPTKMT2AMEN1

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-6184268-B1 MIXING SOLVENT, COLORANT AND LATEX, WHICH IS GENERATED FROM POLYMERIZATION OF MIXTURE OF ANIONIC SURFACTANT, NONIONIC SURFACTANT, AND MIXTURE OF OLEFINIC MONOMERS, FOLLOWED BY ADDITION OF ORGANIC SOLVENT TO PRODUCE INK JET INK XEROX CORPORATION 2001-02-06 US disclosed