Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL8550166

Cc1nc(-c2ccc([N+](=O)[O-])cc2)c(C)s1.N

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
HPGD P15428 1/20 0.51
HTT P42858 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
APP P05067 3/20 0.47
MAPT P10636 4/20 0.47
RAB9A P51151 4/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
PKM P14618 2/20 0.47
MAPK1 P28482 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ACHE P22303 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP13 P45452 1/20 0.43
GAA P10253 2/20 0.43
MGAM O43451 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
SCHEMBL12491432 0.84 MAPT (0.61) ALDH1A1HTTSMN1; SMN2APPMAPT
SCHEMBL4311452 0.83 SMN1; SMN2 (0.48) ALDH1A1HTTSMN1; SMN2APPMAPT
SCHEMBL8552540 0.80 MAPT (0.56) ALDH1A1HPGDHTTSMN1; SMN2APP
SCHEMBL14551144 0.77 HTT (0.52) ALDH1A1HTTSMN1; SMN2MAPTRAB9A
SCHEMBL7951904 0.75 ALDH1A1 (0.65) ALDH1A1HPGDSMN1; SMN2MAPTKMT2A
Ammonia Solution, Strong SCHEMBL8553360 0.74 ALDH1A1 (0.59) ALDH1A1HPGDSMN1; SMN2APPMAPT
SCHEMBL1458965 0.74 CHRNB2 (0.51) ALDH1A1HTTSMN1; SMN2APPMAPT
SCHEMBL1459521 0.74 KDM4E (0.49) ALDH1A1HTTSMN1; SMN2APPMAPT
SCHEMBL2209951 0.72 ACHE (0.46) ALDH1A1HTTSMN1; SMN2APPMAPT
SCHEMBL9379405 0.72 RAB9A (0.48) ALDH1A1HTTSMN1; SMN2APPMAPT

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-0871619-A1 PHENYL THIAZOLE DERIVATIVES WITH ANTI HERPES VIRUS PROPERTIES BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 1998-10-21 EP disclosed
WO-1997024343-A1 PHENYL THIAZOLE DERIVATIVES WITH ANTI HERPES VIRUS PROPERTIES BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 1997-07-10 WO disclosed