Nifuratel

Nifuratel

SCHEMBL16675657

CSC[C@H]1CN(/N=C/c2ccc([N+](=O)[O-])o2)C(=O)O1

nearest known ligand 0.68

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.68
KMT2A Q03164 2/20 0.68
USP2 O75604 1/20 0.68
MAPK9 P45984 1/20 0.68
LMNA P02545 8/20 0.57
ALDH1A1 P00352 6/20 0.57
TP53 P04637 5/20 0.57
MAPT P10636 5/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
CYP1A2 P05177 3/20 0.57
CYP2D6 P10635 1/20 0.57
ALOX15 P16050 1/20 0.57
ATM Q13315 1/20 0.57
MITF O75030 3/20 0.56
TDP1 Q9NUW8 5/20 0.52
MDM2 Q00987 4/20 0.52
KDM4E B2RXH2 2/20 0.52
CYP3A4 P08684 2/20 0.52
ABCC4 O15439 1/20 0.52
TSHR P16473 1/20 0.52

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
Nifuratel SCHEMBL365913 1.00 HIF1A (0.68) HIF1AKMT2AUSP2MAPK9LMNA
Nifuratel SCHEMBL153100 1.00 HIF1A (0.68) HIF1AKMT2AUSP2MAPK9LMNA
Nifuratel SCHEMBL1649685 1.00 HIF1A (0.68) HIF1AKMT2AUSP2MAPK9LMNA
Nifuratel SCHEMBL15375600 1.00 HIF1A (0.68) HIF1AKMT2AUSP2MAPK9LMNA
Nifuratel SCHEMBL153098 1.00 HIF1A (0.68) HIF1AKMT2AUSP2MAPK9LMNA
Nifuratel SCHEMBL15068213 1.00 HIF1A (0.68) HIF1AKMT2AUSP2MAPK9LMNA
Nifuratel SCHEMBL28338979 0.99 HIF1A (0.67) HIF1AKMT2AUSP2MAPK9LMNA
Nifuratel SCHEMBL28086242 0.93 LMNA (0.70) HIF1AKMT2AUSP2MAPK9LMNA
Nifuratel SCHEMBL1237293 0.89 HIF1A (0.56) HIF1AKMT2AUSP2MAPK9LMNA
Nifuratel SCHEMBL27952170 0.88 HIF1A (0.55) HIF1AKMT2AUSP2MAPK9LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9284306-B2 (R)-Nifuratel, its use for the treatment of infections and synthesis of (R) and (S)-Nifuratel POLICHEM SA (LU) 2016-03-15 US disclosed
US-9067927-B2 (R)-Nifuratel, its use for the treatment of infections and synthesis of (R) and (S)-Nifuratel POLICHEM SA (LU) 2015-06-30 US disclosed
US-20150148547-A1 (R)-Nifuratel, its use for the treatment of infections and synthesis of (R) and (S)-Nifuratel POLICHEM SA (LU) 2015-05-28 US disclosed
US-20150119431-A1 (R)-Nifuratel, its use for the treatment of infections and synthesis of (R) and (S)-Nifuratel POLICHEM SA (LU) 2015-04-30 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 (2 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-20150119431-A1 (R)-Nifuratel, its use for the treatment of infections and synthesis of (R) and (S)-Nifuratel BLVRB, NRDC, NISCH HIF1A 4305/4885KMT2A 4642/4885USP2 2807/4885
US-20150148547-A1 (R)-Nifuratel, its use for the treatment of infections and synthesis of (R) and (S)-Nifuratel BLVRB, NRDC, NISCH HIF1A 4305/4885KMT2A 4642/4885USP2 2807/4885

“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.