Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL3586937

N.c1ccc2c3ccc-3c2c1

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
HSD17B10 Q99714 4/20 0.44
CYP2A6 P11509 3/20 0.44
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP1A2 P05177 3/20 0.41
IDO1 P14902 1/20 0.41
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
GPR3 P46089 4/20 0.39
HPRT1 P00492 1/20 0.39
KDM4E B2RXH2 2/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALOX12 P18054 1/20 0.36
MEN1 O00255 1/20 0.35
CDC25B P30305 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
Hydrochloric Acid SCHEMBL27338722 0.96 ALDH1A1 (0.41) ALDH1A1HSD17B10CYP2A6TSHRTDP1
Naphthalene SCHEMBL2270334 0.84 CYP2A6 (0.61) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL16370925 0.81 IDO1 (0.42) ALDH1A1HSD17B10CYP2A6TSHRTDP1
Ammonia Solution, Strong SCHEMBL1656490 0.80 KEAP1 (0.58) ALDH1A1HSD17B10TSHRTDP1CYP1A2
Triphenylene SCHEMBL992206 0.80 HPRT1 (0.53) ALDH1A1HSD17B10CYP2A6TSHRTDP1
Triphenylene SCHEMBL5927226 0.80 HPRT1 (0.53) ALDH1A1HSD17B10CYP2A6TSHRTDP1
Triphenylene SCHEMBL5388604 0.76 HPRT1 (0.50) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL6077039 0.75 ALDH1A1 (0.56) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL13631978 0.75 CYP1A2 (0.47) ALDH1A1CYP1A2MAPK1MEN1KMT2A
Sulfuric Acid SCHEMBL391429 0.75 SMN1; SMN2 (0.46) ALDH1A1HSD17B10TSHRTDP1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2495245-A2 GRAM-POSITIVE CARBAPENEM ANTIBACTERIALS AND PROCESSES FOR THEIR PREPARATION FOB Synthesis, Inc. (US) 2012-09-05 EP disclosed
US-20100075945-A1 GRAM-POSITIVE CARBAPENEM ANTIBACTERIALS AND PROCESSES FOR THEIR PREPARATION CHOI WOO-BAEG 2010-03-25 US disclosed
US-7632828-B2 Gram-positive carbapenem antibacterials and processes for their preparation FOB SYNTHESIS, INC. (US) 2009-12-15 US disclosed
US-20060074070-A1 Gram-positive carbapenem antibacterials and processes for their preparation FOB SYNTHESIS, INC. 2006-04-06 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 (2 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-20060074070-A1 Gram-positive carbapenem antibacterials and processes for their preparation MGAM, GSK3B, GSK3A ALDH1A1 3694/4885HSD17B10 2595/4885CYP2A6 2581/4885
US-20100075945-A1 GRAM-POSITIVE CARBAPENEM ANTIBACTERIALS AND PROCESSES FOR THEIR PREPARATION MGAM, GSK3B, GSK3A ALDH1A1 3694/4885HSD17B10 2595/4885CYP2A6 2581/4885

“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.