SCHEMBL15965828

SCHEMBL15965828

CC(=O)NCCOC(=O)C(C)(C)Br

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 6/20 0.43
MTNR1B P49286 6/20 0.43
MAPK1 P28482 2/20 0.40
TSHR P16473 2/20 0.40
KDM4E B2RXH2 2/20 0.40
USP2 O75604 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HIF1A Q16665 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 4/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
PAOX Q6QHF9 2/20 0.34

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
SCHEMBL21579178 0.84 MAPK1 (0.43) MTNR1AMTNR1BMAPK1TSHRKDM4E
SCHEMBL10065759 0.82 THRB (0.33) ALDH1A1GAASMN1; SMN2
SCHEMBL5974160 0.80 KMT2A (0.41) MTNR1AMTNR1BMAPK1TSHRKDM4E
SCHEMBL1901959 0.80 IDO1 (0.51) ALDH1A1GAA
SCHEMBL19821886 0.79 KDM4E (0.39) MTNR1AMTNR1BMAPK1TSHRKDM4E
SCHEMBL3184969 0.79 IDO1 (0.33) ALDH1A1GAASMN1; SMN2
SCHEMBL36866 0.79 POLB (0.41) TSHRALDH1A1GAA
SCHEMBL18844763 0.78 POLB (0.34) GAA
SCHEMBL25845438 0.78 MTNR1A (0.38) MTNR1AMTNR1BMAPK1TSHRKDM4E
SCHEMBL21733112 0.76 ADH1B (0.35) GAA

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