SCHEMBL8969307

SCHEMBL8969307

C=CCN(CC=C)C(C)CC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 2/20 0.33
SLC22A6 Q4U2R8 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CACNA2D1 P54289 2/20 0.31
CACNB3 P54284 1/20 0.31
CACNA1C Q13936 1/20 0.31
PGR P06401 1/20 0.31
ADRA1A P35348 1/20 0.31
HTR2B P41595 1/20 0.31
CACNA2D2 Q9NY47 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL9300574 0.82 TET2 (0.39) KMT2AALDH1A1MEN1KDM4E
SCHEMBL8756239 0.82 MEN1 (0.33) KMT2AALDH1A1MEN1
SCHEMBL9774591 0.79 KMT2A (0.41) KMT2AALDH1A1MEN1KDM4ETDP1
SCHEMBL10714615 0.75 EPOR (0.40) ALDH1A1SLC22A6TDP1LMNASMN1; SMN2
SCHEMBL2550190 0.74 SMPD2 (0.41) KMT2AALDH1A1MEN1KDM4ELMNA
SCHEMBL89279 0.73 KMT2A (0.33) KMT2AALDH1A1MEN1KDM4ETDP1
SCHEMBL103177 0.73 PGR (0.39) ALDH1A1SLC22A6CACNA2D1CACNB3CACNA1C
SCHEMBL13324872 0.73 CACNA2D1 (0.40) ALDH1A1SLC22A6CACNA2D1CACNB3CACNA1C
SCHEMBL11426408 0.73 MEN1 (0.33) KMT2AMEN1TDP1
SCHEMBL104890 0.73 PGR (0.39) ALDH1A1SLC22A6CACNA2D1CACNB3CACNA1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1070450-A None JP disclosed
EP-0473871-B1 Fluorine-containing compounds MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 1996-02-07 EP disclosed
US-5266724-A Magnetic recording media lubricant MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1993-11-30 US disclosed
US-5188747-A Utilized in magnetic recording media for lubrication and rust prevention MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1993-02-23 US disclosed
EP-0473871-A2 Fluorine-containing compounds MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1992-03-11 EP disclosed
US-4985556-A INTERMEDIATES AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY (JP) 1991-01-15 US disclosed
JP-S6470450-A NOVEL NITROGEN-CONTAINING PERFLUOROCARBOXYLIC FLUORIDE AND ITS PREPARATION AGENCY IND SCIENCE TECHN 1989-03-15 JP disclosed