SCHEMBL3235752

SCHEMBL3235752

CCCCCCCCCCCCCCCCOC(CCCN)OCCCCCCCCCCCCCCCC

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.53
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.48
EPHX1 P07099 1/20 0.48
CA1 P00915 8/20 0.41
CA2 P00918 8/20 0.41
CA9 Q16790 7/20 0.41
CA12 O43570 3/20 0.41
CA7 P43166 3/20 0.41
CA14 Q9ULX7 3/20 0.41
CA3 P07451 2/20 0.41
CA4 P22748 2/20 0.41
CA6 P23280 2/20 0.41
CA5A P35218 2/20 0.41
CA5B Q9Y2D0 2/20 0.41

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
SCHEMBL3244710 1.00 DNM1 (0.53) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL21599287 1.00 DNM1 (0.53) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL4172517 1.00 DNM1 (0.53) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL3242905 1.00 DNM1 (0.53) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL21886512 0.94 DNM1 (0.52) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL8432808 0.89 DNM1 (0.55) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL1817035 0.89 DNM1 (0.55) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL4275158 0.89 DNM1 (0.55) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL4271916 0.89 DNM1 (0.55) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL4275678 0.89 DNM1 (0.55) DNM1MEN1KMT2AALDH1A1TSHR

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
WO-2010030739-A1 POLYETHYLENE GLYCOL LIPID CONJUGATES AND USES THEREOF ABBOTT LABORATORIES (US) 2010-03-18 WO disclosed
WO-2009129385-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO disclosed
WO-2009129387-A2 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO disclosed
WO-2009129395-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO disclosed