SCHEMBL1391547

SCHEMBL1391547

CCOc1nc(NCc2cccnc2)nc(NCc2ccco2)n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 4/20 0.64
▸ MAPT P10636 3/20 0.64
▸ NPSR1 Q6W5P4 2/20 0.62
▸ HTT P42858 1/20 0.62
▸ ALDH1A1 P00352 5/20 0.62
▸ MEN1 O00255 2/20 0.62
▸ KMT2A Q03164 2/20 0.62
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ RAD52 P43351 2/20 0.48
▸ PKM P14618 1/20 0.48
▸ KCNH3 Q9ULD8 2/20 0.47
▸ ADORA3 P0DMS8 1/20 0.46
▸ ADORA2A P29274 1/20 0.46
▸ ADORA2B P29275 1/20 0.46
▸ ADORA1 P30542 1/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ TP53 P04637 1/20 0.45

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
SCHEMBL1390817 0.83 MAPT (0.70) MAPK1MAPTNPSR1HTTALDH1A1
SCHEMBL1391233 0.81 SMN1; SMN2 (0.66) MAPK1MAPTNPSR1HTTALDH1A1
SCHEMBL10243636 0.80 MAPT (0.79) MAPK1MAPTNPSR1HTTALDH1A1
SCHEMBL1391275 0.79 MAPT (0.74) MAPK1MAPTNPSR1HTTALDH1A1
SCHEMBL1390913 0.79 MAPK1 (0.66) MAPK1MAPTNPSR1HTTALDH1A1
SCHEMBL1391509 0.79 MAPT (0.61) MAPK1MAPTNPSR1HTTALDH1A1
SCHEMBL1391434 0.78 MAPT (0.68) MAPK1MAPTNPSR1HTTALDH1A1
SCHEMBL1390720 0.77 MAPT (0.78) MAPK1MAPTNPSR1HTTALDH1A1
SCHEMBL1391101 0.77 MAPT (0.78) MAPK1MAPTNPSR1HTTALDH1A1
SCHEMBL1390856 0.77 MAPT (0.78) MAPK1MAPTNPSR1HTTALDH1A1

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-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof PROGENICS PHARMACEUTICALS, INC. (US) 2012-01-12 — — US disclosed
US-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof PROGENICS PHARMACEUTICALS, INC. (US) 2012-01-12 — — US disclosed
US-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof PROGENICS PHARMACEUTICALS, INC. (US) 2012-01-12 — — US disclosed
EP-2231624-A2 TRIAZINES AND RELATED COMPOUNDS HAVING ANTIVIRAL ACTIVITY, COMPOSITIONS AND METHODS THEREOF Progenics Pharmaceuticals, Inc. (US) 2010-09-29 — — EP disclosed
WO-2009091388-A2 TRIAZINES AND RELATED COMPOUNDS HAVING ANTIVIRAL ACTIVITY, COMPOSITIONS AND METHODS THEREOF PROGENICS PHARMACEUTICALS, INC. (US) 2009-07-23 — — 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 (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-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof HAVCR2, ZC3HAV1, MAVS MAPK1 2676/4885MAPT 3654/4885NPSR1 3221/4885

“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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