SCHEMBL4335355

SCHEMBL4335355

CCCCCOOC(N)N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.40
OPRM1 P35372 1/20 0.39
CA1 P00915 9/20 0.38
CA2 P00918 9/20 0.38
CA9 Q16790 8/20 0.38
CA12 O43570 3/20 0.37
CA7 P43166 3/20 0.37
CA14 Q9ULX7 3/20 0.37
CA3 P07451 2/20 0.37
CA4 P22748 2/20 0.37
CA6 P23280 2/20 0.37
CA5A P35218 2/20 0.37
CA5B Q9Y2D0 2/20 0.37
HTT P42858 1/20 0.36
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
TSHR P16473 1/20 0.33
THRB P10828 1/20 0.33
USP2 O75604 1/20 0.33

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
SCHEMBL7717593 0.98 DNM1 (0.43) DNM1OPRM1CA1CA2CA9
SCHEMBL642173 0.98 DNM1 (0.43) DNM1OPRM1CA1CA2CA9
SCHEMBL31441390 0.98 DNM1 (0.43) DNM1OPRM1CA1CA2CA9
SCHEMBL715456 0.84 DNM1 (0.41) DNM1OPRM1CA1CA2CA9
SCHEMBL4216585 0.84 DNM1 (0.41) DNM1OPRM1CA1CA2CA9
SCHEMBL1809443 0.84 DNM1 (0.41) DNM1OPRM1CA1CA2CA9
SCHEMBL3455284 0.82 DNM1 (0.39) DNM1OPRM1CA1CA2CA9
SCHEMBL6858649 0.77 DNM1 (0.37) DNM1OPRM1CA1CA2CA9
SCHEMBL8346721 0.76 DNM1 (0.38) DNM1OPRM1CA1CA2CA9
SCHEMBL28079091 0.75 THRB (0.40) DNM1CA1CA2CA9HTT

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
US-7611628-B1 Aligned nanotubule membranes UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2009-11-03 US disclosed