SCHEMBL7045767

SCHEMBL7045767

Cc1nc(-c2nc(N(Cc3ccccc3)Cc3ccccc3)nc(C)c2[N+](=O)[O-])c[nH]1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.37
LMNA P02545 6/20 0.37
MAPK1 P28482 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TP53 P04637 1/20 0.35
ALDH1A1 P00352 3/20 0.34
HTT P42858 2/20 0.34
CRHR1 P34998 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PPIA P62937 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL7044720 0.91 CRHR1 (0.42) MAPTLMNAMAPK1SMN1; SMN2TDP1
SCHEMBL7043666 0.90 MAPT (0.47) MAPTLMNAMAPK1SMN1; SMN2TDP1
SCHEMBL7045359 0.83 PPIA (0.40) MAPTLMNAMAPK1SMN1; SMN2TDP1
SCHEMBL7046838 0.82 MAPT (0.49) MAPTMAPK1SMN1; SMN2TDP1L3MBTL1
SCHEMBL7042024 0.80 MAPT (0.46) MAPTLMNATP53ALDH1A1HTT
SCHEMBL7043673 0.77 LMNA (0.50) MAPTLMNASMN1; SMN2TP53ALDH1A1
SCHEMBL7046809 0.75 MAPT (0.39) MAPTLMNAHTTMEN1KMT2A
SCHEMBL7048647 0.75 LMNA (0.47) MAPTLMNASMN1; SMN2TP53ALDH1A1
SCHEMBL7046198 0.74 MAPT (0.40) MAPTLMNATP53MEN1KMT2A
SCHEMBL7044716 0.73 MAPT (0.42) MAPTMAPK1TDP1L3MBTL1ALDH1A1

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
WO-2002064096-A9 METHODS OF USING PYRIMIDINE-BASED ANTIVIRAL AGENTS TULARIK INC (US) 2003-10-16 WO disclosed
US-20030130264-A1 Methods of using pyrimidine-based antiviral agents TULARIK INC. (US) 2003-07-10 US disclosed
WO-2002064096-A2 METHODS OF USING PYRIMIDINE-BASED ANTIVIRAL AGENTS TULARIK INC. (US) 2002-08-22 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-20030130264-A1 Methods of using pyrimidine-based antiviral agents TYMP, TYMS, NUDT1 MAPT 2656/4885LMNA 4154/4885MAPK1 3896/4885

“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.