SCHEMBL15965830

SCHEMBL15965830

CC(C)C(C)(C(=O)OC(C)(C)C)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.48
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA12 O43570 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CYP2D6 P10635 1/20 0.32
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31
APLNR P35414 1/20 0.31
USP2 O75604 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HRH3 Q9Y5N1 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
SCHEMBL12199750 0.78 DGAT1 (0.48) DGAT1CA1CA2CA7CA12
SCHEMBL13206619 0.78 DGAT1 (0.48) DGAT1CA1CA2CA7CA12
SCHEMBL16501325 0.78 DGAT1 (0.48) DGAT1CA1CA2CA7CA12
SCHEMBL7758864 0.76 DGAT1 (0.31) DGAT1
SCHEMBL21811154 0.76 DGAT1 (0.46) DGAT1CA1CA2CA7CA12
SCHEMBL4676907 0.74 DGAT1 (0.50) DGAT1CA1CA2CA7CA12
SCHEMBL13478314 0.74 DGAT1 (0.44) DGAT1CA1CA2CA7CA12
SCHEMBL5895740 0.74 DGAT1 (0.44) DGAT1CA1CA2CA7CA12
SCHEMBL5326515 0.74 DGAT1 (0.44) DGAT1CA1CA2CA7CA12
SCHEMBL14408786 0.74 DGAT1 (0.44) DGAT1CA1CA2CA7CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9132389-B2 Magnetically responsive membranes COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2015-09-15 US disclosed
US-20140231351-A1 MAGNETICALLY RESPONSIVE MEMBRANES COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2014-08-21 US disclosed