SCHEMBL9801697

SCHEMBL9801697

CCCCCCCCCCCCOC(=O)CC[C@H](NC(=O)CCCCCCCCCCC)C(=O)OCCCCCCCCCCCC

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.69
NOD1 Q9Y239 7/20 0.65
POLB P06746 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.54
DGKA P23743 1/20 0.51
MEN1 O00255 1/20 0.49
FAAH O00519 1/20 0.49
MAPK1 P28482 1/20 0.49
PLA2G2C Q5R387 1/20 0.48
DNM1 Q05193 1/20 0.48
NAAA Q02083 1/20 0.47
EPHX2 P34913 1/20 0.47
HTR2C P28335 1/20 0.47

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
SCHEMBL3766774 1.00 KMT2A (0.69) KMT2ANOD1POLBL3MBTL1DGKA
SCHEMBL8526560 1.00 KMT2A (0.69) KMT2ANOD1POLBL3MBTL1DGKA
SCHEMBL3766782 1.00 KMT2A (0.69) KMT2ANOD1POLBL3MBTL1DGKA
SCHEMBL8526564 1.00 KMT2A (0.69) KMT2ANOD1POLBL3MBTL1DGKA
SCHEMBL9801689 1.00 KMT2A (0.69) KMT2ANOD1POLBL3MBTL1DGKA
SCHEMBL3766841 0.97 KMT2A (0.69) KMT2ANOD1POLBL3MBTL1DGKA
SCHEMBL3766835 0.97 KMT2A (0.69) KMT2ANOD1POLBL3MBTL1DGKA
SCHEMBL5490514 0.95 KMT2A (0.63) KMT2ANOD1POLBL3MBTL1DGKA
SCHEMBL22589087 0.94 KMT2A (0.79) KMT2ANOD1POLBL3MBTL1DGKA
SCHEMBL8506867 0.94 KMT2A (0.61) KMT2ANOD1POLBL3MBTL1DGKA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-57200472-A None JP disclosed
US-5064806-A CONTAINING AN ALKYLAMMONIUM SALT; HIGH COLOR DENSITY, LOW BACKGROUND STRAIN MITSUBISHI PAPER MILLS LIMITED (JP) 1991-11-12 US disclosed
JP-S57200472-A BACK-FLOW PREVENTING COMPOSITION FOR WRITING INK SAKURA COLOR PROD CORP 1982-12-08 JP disclosed