SCHEMBL1448192

SCHEMBL1448192

C=CCc1c(F)ccc([N+](=O)[O-])c1C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.40
POLB P06746 1/20 0.40
ABL1 P00519 1/20 0.40
BCR P11274 1/20 0.40
CYP2C19 P33261 2/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ABCC4 O15439 1/20 0.36
PLIN1 O60240 1/20 0.36
CACNA1F O60840 1/20 0.36
GMNN O75496 1/20 0.36
KCNK2 O95069 1/20 0.36
ABCB11 O95342 1/20 0.36
GSR P00390 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL1448819 0.83 ABL1 (0.39) TDP1ABL1BCRCYP2C19ALDH1A1
SCHEMBL1448737 0.82 KMT2A (0.37) TDP1ABL1BCRCYP2C19ALDH1A1
SCHEMBL3885787 0.81 ALDH1A1 (0.40) TDP1POLBCYP2C19ALDH1A1SMN1; SMN2
SCHEMBL1449060 0.80 CYP4A11 (0.40) TDP1ABL1BCRCYP2C19ALDH1A1
SCHEMBL1448297 0.80 FBP1 (0.43) ALDH1A1KMT2ALMNA
SCHEMBL30395006 0.78 SMN1; SMN2 (0.42) TDP1CYP2C19ALDH1A1SMN1; SMN2MAPT
SCHEMBL1448702 0.78 SMN1; SMN2 (0.35) TDP1ABL1BCRCYP2C19ALDH1A1
SCHEMBL3882438 0.76 GPR35 (0.42) TDP1POLBABL1BCRALDH1A1
SCHEMBL1448325 0.76 KMT2A (0.44) TDP1CYP2C19ALDH1A1SMN1; SMN2MAPT
SCHEMBL1448706 0.76 ABL1 (0.35) TDP1POLBABL1BCRCYP2C19

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1784399-B1 PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2011-06-15 EP disclosed
EP-1784399-B1 PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2011-06-15 EP disclosed
US-7910585-B2 Pyrimidine derivatives NOVARTIS AG (CH) 2011-03-22 US disclosed
US-7910585-B2 Pyrimidine derivatives NOVARTIS AG (CH) 2011-03-22 US disclosed
US-7910585-B2 Pyrimidine derivatives NOVARTIS AG (CH) 2011-03-22 US disclosed
US-20080293708-A1 Pyrimidine Derivatives NOVARTIS AG (CH) 2008-11-27 US disclosed
US-20080293708-A1 Pyrimidine Derivatives NOVARTIS AG (CH) 2008-11-27 US disclosed
US-20080293708-A1 Pyrimidine Derivatives NOVARTIS AG (CH) 2008-11-27 US disclosed
EP-1784399-A2 PYRIMIDINE DERIVATIVES Novartis AG (CH) 2007-05-16 EP disclosed
WO-2006021457-A2 PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2006-03-02 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-20080293708-A1 Pyrimidine Derivatives DPYD, TYMP, TYMS TDP1 334/4885POLB 35/4885ABL1 751/4885

“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.