Ethane

Ethane

SCHEMBL7553162

CC.NSc1ncccc1[N+](=O)[O-]

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 4/20 0.54
ALDH1A1 P00352 4/20 0.51
PKM P14618 1/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
PDE10A Q9Y233 1/20 0.49
POLB P06746 2/20 0.47
MAPK1 P28482 1/20 0.46
PAX8 Q06710 1/20 0.44
NCOA1 Q15788 1/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
RAB9A P51151 2/20 0.43
HTT P42858 2/20 0.42

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
SCHEMBL112949 0.96 MEN1 (0.58) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL27838730 0.82 MEN1 (0.56) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL4988971 0.82 SMN1; SMN2 (0.61) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL70297 0.82 MEN1 (0.61) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL29627490 0.82 MEN1 (0.61) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL6849222 0.82 MEN1 (0.71) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL13402273 0.79 L3MBTL1 (0.58) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL13596619 0.79 SMN1; SMN2 (0.58) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL31676628 0.79 SMN1; SMN2 (0.58) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL70296 0.79 MEN1 (0.58) MEN1KMT2ASMN1; SMN2GAAMAPT

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
EP-1263472-A2 MODIFICATION OF BIOPOLYMERS FOR IMPROVED DRUG DELIVERY GENZYME CORPORATION (US) 2002-12-11 EP disclosed
WO-2001060412-A2 MODIFICATION OF BIOPOLYMERS FOR IMPROVED DRUG DELIVERY GENZYME CORPORATION (US) 2001-08-23 WO disclosed