Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL2954085

N.O=C(O)c1sc2c(ccc(=O)n2Cc2ccccc2)c1Nc1ccccc1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 1/20 0.42
CCND1 P24385 1/20 0.42
CCND2 P30279 1/20 0.42
CCND3 P30281 1/20 0.42
EGLN1 Q9GZT9 2/20 0.38
MAPT P10636 3/20 0.37
GAA P10253 2/20 0.37
TP53 P04637 1/20 0.37
ALDH1A1 P00352 5/20 0.36
TDP1 Q9NUW8 1/20 0.36
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
BRD4 O60885 1/20 0.36
BRD2 P25440 1/20 0.36
BRD3 Q15059 1/20 0.36
BRDT Q58F21 1/20 0.36
KDM4E B2RXH2 4/20 0.36
HSD17B10 Q99714 1/20 0.36
KMT2A Q03164 5/20 0.35
SMN1; SMN2 Q16637 3/20 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
SCHEMBL2955552 0.89 CDK4 (0.41) CDK4CCND1CCND2CCND3EGLN1
SCHEMBL2952262 0.85 ALDH1A1 (0.52) MAPTGAAALDH1A1TDP1KDM4E
Ammonia Solution, Strong SCHEMBL2958678 0.83 CDK4 (0.41) CDK4CCND1CCND2CCND3MAPT
Ammonia Solution, Strong SCHEMBL1267334 0.81 CDK4 (0.38) CDK4CCND1CCND2CCND3MAPT
SCHEMBL2949022 0.73 CDK4 (0.40) CDK4CCND1CCND2CCND3MAPT
SCHEMBL2957695 0.71 CXCR2 (0.40) CDK4CCND1CCND2CCND3MAPT
SCHEMBL2958436 0.70 KMT2A (0.41) CDK4CCND1CCND2CCND3MAPT
SCHEMBL2958575 0.70 CDK4 (0.38) CDK4CCND1CCND2CCND3MAPT
SCHEMBL2952675 0.70 KMT2A (0.41) CDK4CCND1CCND2CCND3ALDH1A1
SCHEMBL27617043 0.70 FEN1 (0.41) ALDH1A1KMT2AFEN1PKML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1569953-B1 PEPTIDE GAP JUNCTION MODULATORS ZEALAND PHARMA AS (DK) 2010-09-29 EP disclosed
US-7763729-B2 Bicyclic heteroaromatic derivatives UCB PHARMA S.A. (BE) 2010-07-27 US disclosed
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives CELLTECH R&D LIMITED (GB) 2009-02-12 US disclosed
US-7423047-B2 Arylamine substituted bicyclic heteroaromatic compounds as p38 kinase inhibitors CELLTECH R&D LIMITED (GB) 2008-09-09 US disclosed
US-20060194947-A1 Peptide gap junction modulators ZEALAND PHARMA A/S (DK) 2006-08-31 US disclosed
US-20060004025-A1 Arylamine substututed bicyclic heteroaromatic compounds as p38 kinase inhibitors UCB PHARMA S.A. (BE) 2006-01-05 US disclosed
EP-1569953-A1 PEPTIDE GAP JUNCTION MODULATORS Zealand Pharma A/S (DK) 2005-09-07 EP disclosed
WO-2004048400-A1 PEPTIDE GAP JUNCTION MODULATORS ZEALAND PHARMA A/S (DK) 2004-06-10 WO 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-20060004025-A1 Arylamine substututed bicyclic heteroaromatic compounds as p38 kinase inhibitors MAPK1, CNKSR1, ALK CDK4 743/4885CCND1 655/4885CCND2 932/4885
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives MAPK1, CNKSR1, CBR1 CDK4 689/4885CCND1 533/4885CCND2 932/4885
US-20060194947-A1 Peptide gap junction modulators GJA1, GJB2, GAP43 CDK4 4052/4885CCND1 4549/4885CCND2 4569/4885

“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.