SCHEMBL8070740

SCHEMBL8070740

CCCCNOCCCC.CCCCOC(N)CCC

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.31
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
ADRB3 P13945 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
SCHEMBL22944756 0.91 CA1 (0.31)
SCHEMBL309264 0.83 ADRB2 (0.42) DNM1ADRB2ADRB1ADRB3
SCHEMBL309262 0.79 CA1 (0.40) ADRB2ADRB1ADRB3
SCHEMBL8070734 0.79 CA1 (0.40) ADRB2ADRB1ADRB3
Hydrochloric Acid SCHEMBL8958720 0.77 CA1 (0.39) ADRB2ADRB1ADRB3
SCHEMBL7617286 0.75 DNM1 (0.52) DNM1
SCHEMBL10521005 0.73 OPRM1 (0.48) DNM1ADRB2ADRB1ADRB3
SCHEMBL10106994 0.72 EPHX1 (0.42) ADRB2ADRB1ADRB3
SCHEMBL5187696 0.72 TSHR (0.46) ADRB2ADRB1ADRB3
SCHEMBL5671464 0.72 OPRM1 (0.32) DNM1

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
EP-0678504-B1 A process for producing substituted amines and a method for purifying synthetic intermediates therefor MITSUI CHEMICALS INC (JP) 2000-06-21 EP disclosed