Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL308383

CC(c1ccc2ccccc2c1)c1cc(Cl)nc(N)n1.N

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 1/20 0.48
UGT2B7 P16662 1/20 0.42
ADRA2A P08913 3/20 0.42
ADRA2B P18089 3/20 0.42
ADRA2C P18825 3/20 0.42
HSP90AA1 P07900 3/20 0.40
HSP90AB1 P08238 3/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP2D6 P10635 4/20 0.38
CYP3A4 P08684 3/20 0.38
SLC6A2 P23975 3/20 0.38
SLC6A4 P31645 3/20 0.38
SLC6A3 Q01959 3/20 0.38
CYP1A2 P05177 2/20 0.36
KCNH2 Q12809 1/20 0.36
AOC3 Q16853 1/20 0.35
MEN1 O00255 1/20 0.35
TSHR P16473 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL27726716 0.81 SMN1; SMN2 (0.49) SMN1; SMN2LMNAUGT2B7HSP90AA1HSP90AB1
SCHEMBL27726697 0.75 UGT2B7 (0.50) UGT2B7ADRA2AADRA2BADRA2CCYP2D6
SCHEMBL308382 0.75 NUDT1 (0.53) SMN1; SMN2LMNAUGT2B7CYP2D6KMT2A
SCHEMBL320356 0.74 NUDT1 (0.51) SMN1; SMN2LMNAUGT2B7ADRA2AADRA2B
SCHEMBL760321 0.74 HRH3 (0.46) SMN1; SMN2LMNAHSP90AA1HSP90AB1KDM4E
SCHEMBL16746751 0.74 ADRA2A (0.47) UGT2B7ADRA2AADRA2BADRA2CCYP2D6
SCHEMBL28806243 0.70 UGT2B7 (0.61) UGT2B7ADRA2AADRA2BADRA2CCYP2D6
SCHEMBL308850 0.69 TPH1 (0.54)
SCHEMBL307720 0.69 TPH1 (0.54)
SCHEMBL28849339 0.67 NUDT1 (0.43) KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130137635-A1 TRYPTOPHAN HYDROXYLASE INHIBITORS FOR THE TREATMENT OF METASTATIC BONE DISEASE LEXICON PHARMACEUTICALS, INC. (US) 2013-05-30 US disclosed
US-8093291-B2 Methods of using and compositions comprising tryptophan hydroxylase inhibitors LEXICON PHARMACEUTICALS, INC. (US) 2012-01-10 US disclosed
US-7723345-B2 Multicyclic amino acid derivatives and methods of their use LEXICON PHARMACEUTICALS, INC. (US) 2010-05-25 US disclosed
US-20090005382-A1 METHODS OF USING AND COMPOSITIONS COMPRISING TRYPTOPHAN HYDROXYLASE INHIBITORS TERSERA THERAPEUTICS LLC 2009-01-01 US disclosed
US-20070191370-A1 Multicyclic amino acid derivatives and methods of their use TERSERA THERAPEUTICS LLC 2007-08-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070191370-A1 Multicyclic amino acid derivatives and methods of their use AADAT, HNMT, TPH1 SMN1; SMN2 885/4885LMNA 1647/4885UGT2B7 321/4885
US-20130137635-A1 TRYPTOPHAN HYDROXYLASE INHIBITORS FOR THE TREATMENT OF METASTATIC BONE DISEASE TPH1, TPH2, IDO1 SMN1; SMN2 3954/4885LMNA 3504/4885UGT2B7 2190/4885
US-20090005382-A1 METHODS OF USING AND COMPOSITIONS COMPRISING TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, MAOB SMN1; SMN2 3030/4885LMNA 2764/4885UGT2B7 154/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.