Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL1963768

CC(C)(C)OC(=O)OC(=O)C1CCCN1C(=O)OC(C)(C)C.N

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.51
NPC1 O15118 1/20 0.48
LMNA P02545 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
EPHX2 P34913 1/20 0.46
UCHL1 P09936 1/20 0.45
KLK7 P49862 1/20 0.44
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL6219879 0.91 HSD17B10 (0.59) HSD17B10SMN1; SMN2NPC1LMNANPSR1
SCHEMBL23477366 0.91 HSD17B10 (0.59) HSD17B10SMN1; SMN2NPC1LMNANPSR1
SCHEMBL9727398 0.91 HSD17B10 (0.59) HSD17B10SMN1; SMN2NPC1LMNANPSR1
SCHEMBL9544779 0.91 HSD17B10 (0.59) HSD17B10SMN1; SMN2NPC1LMNANPSR1
SCHEMBL15922456 0.90 HSD17B10 (0.53) HSD17B10SMN1; SMN2NPC1LMNANPSR1
SCHEMBL16774272 0.86 KMT2A (0.52) HSD17B10SMN1; SMN2NPC1LMNANPSR1
SCHEMBL19414808 0.86 HSD17B10 (0.61) HSD17B10SMN1; SMN2NPC1LMNANPSR1
SCHEMBL7286305 0.86 HSD17B10 (0.61) HSD17B10SMN1; SMN2NPC1LMNANPSR1
SCHEMBL895773 0.86 HSD17B10 (0.61) HSD17B10SMN1; SMN2NPC1LMNANPSR1
SCHEMBL12894181 0.85 HSD17B10 (0.54) HSD17B10SMN1; SMN2NPC1LMNANPSR1

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-2509942-A2 BIS-ACYLATED HYDROXYLAMINE DERIVATIVES Johns Hopkins University (US) 2012-10-17 EP disclosed
WO-2011071947-A2 BIS-ACYLATED HYDROXYLAMINE DERIVATIVES JOHNS HOPKINS UNIVERSITY (US) 2011-06-16 WO disclosed