SCHEMBL14058478

SCHEMBL14058478

CC(C)(C)OC(=O)N1c2ccc(N)cc2Sc2cc(N)ccc21

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 15/20 0.64
▸ NOX1 Q9Y5S8 2/20 0.45
▸ NR1H2 P55055 1/20 0.45
▸ SNCA P37840 1/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ ADRA2A P08913 1/20 0.44
▸ ADRA2B P18089 1/20 0.44
▸ ADRA2C P18825 1/20 0.44
▸ CHRM3 P20309 1/20 0.44
▸ SLC6A2 P23975 1/20 0.44
▸ HTR2C P28335 1/20 0.44
▸ SLC6A4 P31645 1/20 0.44
▸ DRD3 P35462 1/20 0.44
▸ HTR2B P41595 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ ALOX12 P18054 1/20 0.36

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
SCHEMBL19918106 0.91 SNCA (0.60) BCHENOX1NR1H2SNCAMEN1
SCHEMBL29406451 0.91 SNCA (0.60) BCHENOX1NR1H2SNCAMEN1
SCHEMBL31022783 0.82 BCHE (0.64) BCHENOX1MEN1KMT2AMAPT
SCHEMBL12813131 0.82 BCHE (0.64) BCHENOX1MEN1KMT2AMAPT
SCHEMBL10083549 0.80 BCHE (0.61) BCHESNCAMEN1KMT2AL3MBTL1
SCHEMBL14142982 0.80 BCHE (0.61) BCHENOX1SNCA
SCHEMBL29850660 0.78 NOX1 (0.58) BCHENOX1SNCAMEN1KMT2A
SCHEMBL1208165 0.78 NOX1 (0.58) BCHENOX1SNCAMEN1KMT2A
Ammonia Solution, Strong SCHEMBL1927787 0.76 NOX1 (0.56) BCHENOX1SNCAMEN1KMT2A
Hydrochloric Acid SCHEMBL1929442 0.76 NOX1 (0.56) BCHENOX1SNCAMEN1KMT2A

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
US-8809317-B2 Antiviral compounds PROSETTA ANTIVIRAL INC. (US) 2014-08-19 — — US disclosed
US-20120302556-A1 Antiviral Compounds PROSETTA ANTIVIRAL INC. (US) 2012-11-29 — — 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 (1 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-20120302556-A1 Antiviral Compounds HAVCR2, MAVS, EIF2AK2 BCHE 857/4885NOX1 2733/4885NR1H2 1330/4885

“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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