SCHEMBL9706148

SCHEMBL9706148

CCN(CC)C(C)Oc1cccc(OC(C)N(CC)CC)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
TSHR P16473 1/20 0.39
ACHE P22303 2/20 0.39
FAAH O00519 1/20 0.39
BCHE P06276 1/20 0.39
MTNR1A P48039 6/20 0.38
MTNR1B P49286 6/20 0.38
PGR P06401 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
HTR2A P28223 1/20 0.38
HRH1 P35367 1/20 0.38
KCNH2 Q12809 1/20 0.38
NSD2 O96028 1/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HPGD P15428 1/20 0.36
GPBAR1 Q8TDU6 1/20 0.35
CYSLTR1 Q9Y271 1/20 0.35
HIF1A Q16665 1/20 0.35

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
SCHEMBL10429856 0.86 ADRA2A (0.43) KDM4EBCHEMTNR1AMTNR1BPGR
Hydrochloric Acid SCHEMBL15412521 0.84 ADRA2A (0.42) KDM4ETSHRACHEBCHEMTNR1A
SCHEMBL4299736 0.84 KMT2A (0.55) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL11093524 0.84 MAOA (0.44) KDM4EALDH1A1SMN1; SMN2HPGDL3MBTL1
SCHEMBL9706129 0.83 ALDH1A3 (0.39) BCHEPGRADRA2AADRA2BHTR2A
SCHEMBL30999515 0.78 KDM4E (0.47) KDM4EHTR2AKCNH2ALDH1A1
SCHEMBL3163544 0.77 BCHE (0.31) BCHEPGRADRA2AADRA2BHTR2A
SCHEMBL11684270 0.77 BCHE (0.42) KDM4ETSHRBCHEADRA2AADRA2B
SCHEMBL3327499 0.76 ALDH1A3 (0.34) BCHEPGRADRA2AADRA2BHTR2A
SCHEMBL11767873 0.76 MAPT (0.48) ALDH1A1SMN1; SMN2L3MBTL1

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