SCHEMBL1392057

SCHEMBL1392057

CCOc1nc(NCc2ccncc2)nc(Nc2ccc3cc[nH]c3c2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH3 Q9ULD8 3/20 0.46
▸ SYK P43405 2/20 0.44
▸ HPGD P15428 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ MAPT P10636 3/20 0.42
▸ LMNA P02545 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ PDE4B Q07343 1/20 0.41
▸ PDE4D Q08499 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ CA9 Q16790 2/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ THRB P10828 1/20 0.39

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
SCHEMBL1392730 0.88 POLB (0.52) SYKHPGDPOLBMAPTLMNA
SCHEMBL1392137 0.83 MAPT (0.47) KCNH3HPGDPOLBMAPTLMNA
SCHEMBL1392083 0.81 MAPT (0.66) KCNH3SYKMAPTMEN1KMT2A
SCHEMBL1392295 0.81 MAPT (0.46) SYKHPGDPOLBMAPTLMNA
SCHEMBL1392367 0.79 ESR1 (0.44) KCNH3SYKLMNAMEN1KMT2A
SCHEMBL1392426 0.78 MEN1 (0.45) KCNH3SYKLMNAMEN1KMT2A
SCHEMBL1391546 0.78 PDE4B (0.70) KCNH3HPGDPOLBMAPTLMNA
SCHEMBL1391497 0.77 KCNH3 (0.49) KCNH3SYKLMNAMEN1KMT2A
SCHEMBL1391549 0.76 LMNA (0.54) MAPTLMNAMAPK1
SCHEMBL1391765 0.76 TDP1 (0.43) KCNH3SYKHPGDPOLBMAPT

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 1 patent. 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

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 KCNH3 3535/4885SYK 3830/4885HPGD 3568/4885

“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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