SCHEMBL15028248

SCHEMBL15028248

CN(C)CCCNP(=O)(OI)OI

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.36
PAOX Q6QHF9 1/20 0.34
TSHR P16473 2/20 0.34
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 2/20 0.33
DNM1 Q05193 1/20 0.33
HPGD P15428 1/20 0.32
KMT2A Q03164 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
CA12 O43570 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
POLB P06746 1/20 0.30
ALOX15 P16050 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
SCHEMBL15028245 0.94 TSHR (0.37) TDP1PAOXTSHRALDH1A1KDM4E
SCHEMBL15786595 0.91 TDP1 (0.33) TDP1PAOXTSHRALDH1A1DNM1
SCHEMBL15028247 0.88 PRMT3 (0.37) TDP1ALDH1A1DNM1KMT2ACYP2C9
SCHEMBL15786625 0.85 ALDH1A1 (0.33) PAOXTSHRALDH1A1
SCHEMBL15150904 0.82 TDP1 (0.38) TDP1PAOXTSHRALDH1A1KDM4E
SCHEMBL15786628 0.81 PAOX (0.36) TDP1PAOXTSHRALDH1A1KDM4E
SCHEMBL15786594 0.78 MEN1 (0.34) TDP1ALDH1A1KMT2ACYP2C9CYP2C19
SCHEMBL10081265 0.77 HPGD (0.36) TDP1PAOXTSHRALDH1A1DNM1
SCHEMBL10085303 0.76 TSHR (0.39) TDP1PAOXTSHRALDH1A1KDM4E
SCHEMBL24172211 0.75 TDP1 (0.39) TDP1PAOXTSHRALDH1A1KDM4E

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
WO-2013086322-A1 BRANCHED ALKYL AND CYCLOALKYL TERMINATED BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS ALNYLAM PHARMACEUTICALS, INC. (US) 2013-06-13 WO disclosed