SCHEMBL7048647

SCHEMBL7048647

Cc1nc(-c2nc(C)c([N+](=O)[O-])c(N(C)Cc3ccccc3)n2)c[nH]1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.47
MAPT P10636 7/20 0.46
POLB P06746 3/20 0.46
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C9 P11712 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
METAP2 P50579 1/20 0.46
METAP1 P53582 1/20 0.46
ALDH1A1 P00352 1/20 0.44
PDE5A O76074 1/20 0.39
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
SLC26A6 Q9BXS9 1/20 0.35
CSF1R P07333 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
TP53 P04637 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL7044323 0.83 MAPT (0.61) MAPTCYP1A2CYP3A4NPSR1ALDH1A1
SCHEMBL7043666 0.80 MAPT (0.47) LMNAMAPTPOLBCYP1A2CYP3A4
SCHEMBL6695254 0.79 LMNA (0.55) LMNAMAPTPOLBCYP1A2CYP3A4
SCHEMBL7048650 0.75 LMNA (0.54) LMNAMAPTPOLBMETAP2METAP1
SCHEMBL7045767 0.75 MAPT (0.37) LMNAMAPTCYP1A2CYP2C9ALDH1A1
SCHEMBL7042024 0.74 MAPT (0.46) LMNAMAPTPOLBCYP1A2CYP3A4
SCHEMBL6696084 0.71 LMNA (0.49) LMNAMAPTPOLBCYP1A2CYP3A4
SCHEMBL7046198 0.71 MAPT (0.40) LMNAMAPTPOLBCYP1A2CYP3A4
SCHEMBL7044720 0.69 CRHR1 (0.42) LMNAMAPTSMN1; SMN2TP53TSHR
SCHEMBL27560628 0.69 LMNA (0.45) LMNAMAPTPOLBCYP1A2CYP3A4

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 LMNA 4154/4885MAPT 2656/4885POLB 158/4885

“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.