SCHEMBL1686928

SCHEMBL1686928

COc1ccc(COCC(=O)NCCON=C(C(=O)O)c2csc(NC(c3ccccc3)(c3ccccc3)c3ccccc3)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.38
▸ GAA P10253 3/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ APP P05067 1/20 0.37
▸ PTPN1 P18031 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ AMY1A P0DUB6 1/20 0.36
▸ LMNA P02545 3/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ POLB P06746 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ TP53 P04637 1/20 0.34
▸ HTT P42858 1/20 0.34

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
SCHEMBL1686923 1.00 MAPT (0.38) MAPTGAAKMT2AMEN1NPSR1
SCHEMBL10747586 0.87 MAPT (0.44) MAPTGAAKMT2AMEN1NPSR1
SCHEMBL10804728 0.87 MAPT (0.44) MAPTGAAKMT2AMEN1NPSR1
SCHEMBL10436652 0.80 MAPT (0.39) MAPTGAAKMT2AMEN1NPSR1
SCHEMBL10436646 0.80 MAPT (0.39) MAPTGAAKMT2AMEN1NPSR1
SCHEMBL10746707 0.79 MAPT (0.38) MAPTGAAKMT2AMEN1NPSR1
SCHEMBL10746735 0.79 MAPT (0.38) MAPTGAAKMT2AMEN1NPSR1
SCHEMBL11064923 0.79 MAPT (0.41) MAPTGAAKMT2AMEN1NPSR1
SCHEMBL9805099 0.79 MAPT (0.41) MAPTGAAKMT2AMEN1NPSR1
SCHEMBL9805090 0.79 MAPT (0.41) MAPTGAAKMT2AMEN1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160122320-A1 USEFUL COMBINATIONS OF MONOBACTAM ANTIBIOTICS WITH BETA-LACTAMASE INHIBITORS BASILEA PHARMACEUTICA AG (CH) 2016-05-05 — — US disclosed
US-8901293-B2 Useful combinations of monobactam antibiotics with beta-lactamase inhibitors BASILEA PHARMACEUTICA AG (CH) 2014-12-02 — — US disclosed
EP-2308874-B1 Bridged monobactams useful as beta-lactamase inhibitors BASILEA PHARMACEUTICA AG (CH) 2013-01-23 — — EP disclosed
EP-2484680-A1 Useful Combinations of Monobactam Antibiotics with beta-Lac-tamase Inhibitors Basilea Pharmaceutica AG (CH) 2012-08-08 — — EP disclosed
EP-2308874-A1 Useful beta-lactamase inhibitors Basilea Pharmaceutica AG (CH) 2011-04-13 — — EP disclosed
US-20100056478-A1 Useful Combinations of Monobactam Antibiotics With Beta-Lactamase Inhibitors BASILEA PHARMACEUTICA AG (CH) 2010-03-04 — — 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-20160122320-A1 USEFUL COMBINATIONS OF MONOBACTAM ANTIBIOTICS WITH BETA-LACTAMASE INHIBITORS MGAM, MGAM2, B2M MAPT 3122/4885GAA 24/4885KMT2A 1169/4885
US-20100056478-A1 Useful Combinations of Monobactam Antibiotics With Beta-Lactamase Inhibitors MGAM, MGAM2, B2M MAPT 3096/4885GAA 25/4885KMT2A 1199/4885

“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.

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