SCHEMBL9705183

SCHEMBL9705183

CCN(CC)CCOCCOCCOCCN(CC)CC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.58
POLB P06746 1/20 0.58
KMT2A Q03164 1/20 0.58
CHRM2 P08172 7/20 0.44
CHRM1 P11229 7/20 0.44
KDM4E B2RXH2 3/20 0.44
DRD3 P35462 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44
HSD17B10 Q99714 1/20 0.44
SIGMAR1 Q99720 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2D6 P10635 2/20 0.39
HTT P42858 2/20 0.39
SLC22A1 O15245 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
CYP3A4 P08684 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL12918863 1.00 MEN1 (0.58) MEN1POLBKMT2ACHRM2CHRM1
SCHEMBL135077 0.97 MEN1 (0.61) MEN1POLBKMT2ACHRM2CHRM1
Hydrochloric Acid SCHEMBL11278283 0.94 MEN1 (0.58) MEN1POLBKMT2ACHRM2CHRM1
SCHEMBL24052760 0.92 MEN1 (0.52) MEN1POLBKMT2ACHRM2CHRM1
SCHEMBL18357965 0.92 MEN1 (0.52) MEN1POLBKMT2ACHRM2CHRM1
SCHEMBL18323717 0.89 MEN1 (0.50) MEN1POLBKMT2ACHRM2CHRM1
SCHEMBL22953317 0.89 MEN1 (0.50) MEN1POLBKMT2ACHRM2CHRM1
SCHEMBL30712193 0.89 MEN1 (0.50) MEN1POLBKMT2ACHRM2CHRM1
SCHEMBL4545007 0.89 MEN1 (0.50) MEN1POLBKMT2ACHRM2CHRM1
SCHEMBL5814986 0.88 MEN1 (0.54) MEN1POLBKMT2ACHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0214852-B1 PERFLUOROAMINOETHERS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-10-28 EP disclosed
US-5049670-A Pour point MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-09-17 US disclosed
US-4929725-A NONFLAMMABLE, HYDRAULIC FLUIDS MOORE GEORGE G I (US) 1990-05-29 US disclosed
US-4788339-A HIGH BOILING, LOW POUR POINT; HYDRAULIC FLUIDS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-11-29 US disclosed