SCHEMBL1390848

SCHEMBL1390848

CCOc1nc(Cl)nc(Nc2ccc3c(c2)nc(CN2CCOCC2)n3C)n1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.58
▸ SMN1; SMN2 Q16637 4/20 0.54
▸ LMNA P02545 3/20 0.54
▸ TSHR P16473 1/20 0.54
▸ MAPK1 P28482 1/20 0.53
▸ ALDH1A1 P00352 3/20 0.50
▸ RECQL P46063 1/20 0.50
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ THRB P10828 1/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ MAPT P10636 2/20 0.45
▸ GAA P10253 1/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ USP2 O75604 1/20 0.45
▸ HPGD P15428 1/20 0.44

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
SCHEMBL1391220 0.83 MAPT (0.54) POLBSMN1; SMN2LMNATSHRMAPK1
SCHEMBL1392490 0.83 POLB (0.52) POLBSMN1; SMN2LMNATSHRMAPK1
SCHEMBL1391067 0.70 MAPT (0.47) POLBLMNAALDH1A1RECQLKDM4E
Hydrochloric Acid SCHEMBL1391137 0.69 POLB (0.56) POLBSMN1; SMN2LMNATSHRMAPK1
SCHEMBL15730124 0.67 GRM2 (0.71) POLBSMN1; SMN2LMNAMAPK1KDM4E
SCHEMBL21940529 0.66 CYP3A4 (1.00) SMN1; SMN2LMNATSHRALDH1A1CYP3A4
SCHEMBL19053246 0.66 CYP3A4 (0.83) LMNATSHRALDH1A1CYP3A4CYP2D6
Cyclohexane SCHEMBL4873977 0.65 MAPT (0.82) POLBSMN1; SMN2LMNAMAPK1RECQL
SCHEMBL1390750 0.65 MAPT (0.54) SMN1; SMN2LMNATSHRMAPK1ALDH1A1
SCHEMBL13950335 0.65 POLB (0.66) POLBSMN1; SMN2LMNAMAPK1KDM4E

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 3 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
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 POLB 2680/4885SMN1; SMN2 4526/4885LMNA 3218/4885

“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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