SCHEMBL6449302

SCHEMBL6449302

Cc1ccc(O)c(-c2nc(-c3ncccc3[N+](=O)[O-])no2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.49
KMT2A Q03164 4/20 0.49
HPGD P15428 3/20 0.49
LMNA P02545 2/20 0.49
MAPK1 P28482 2/20 0.46
RAB9A P51151 7/20 0.45
NPC1 O15118 6/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
GAA P10253 2/20 0.44
TP53 P04637 4/20 0.44
MEN1 O00255 2/20 0.43
ALPL P05186 1/20 0.43
POLB P06746 3/20 0.42
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 1/20 0.40
ABCB1 P08183 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39

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
SCHEMBL6452064 0.89 MAPK1 (0.43) MAPTKMT2AHPGDLMNAMAPK1
SCHEMBL6451118 0.88 TDP1 (0.45) MAPTKMT2AHPGDMAPK1RAB9A
SCHEMBL6449963 0.87 MAPT (0.52) MAPTKMT2AHPGDLMNAMAPK1
SCHEMBL6451372 0.87 MAPK1 (0.41) MAPTKMT2AHPGDLMNAMAPK1
SCHEMBL6451234 0.87 MAPT (0.45) MAPTKMT2AHPGDLMNAMAPK1
SCHEMBL6454080 0.86 MAPT (0.52) MAPTKMT2AHPGDMAPK1RAB9A
SCHEMBL6454629 0.85 CASP3 (0.54) MAPTKMT2AHPGDMAPK1RAB9A
SCHEMBL6453543 0.83 NPC1 (0.46) MAPTKMT2AHPGDMAPK1RAB9A
SCHEMBL6452435 0.81 MAPT (0.45) MAPTKMT2AHPGDMAPK1RAB9A
SCHEMBL6451920 0.79 CASP3 (0.51) MAPTKMT2AHPGDMAPK1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus ANADYS PHARMACEUTICALS, INC. (US) 2005-04-07 US disclosed
WO-2004110351-A2 HETEROCYCLIC COMPOUNDS FOR TREATING HEPATITIS C VIRUS ANADYS PHARMACEUTICALS, INC. (US) 2004-12-23 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-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus HAVCR2, HCCS, LIPC MAPT 2805/4885KMT2A 3600/4885HPGD 258/4885

“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.