SCHEMBL7328574

SCHEMBL7328574

Cn1cccc1-c1cc(O)n(-c2ccc([N+](=O)[O-])cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
POLB P06746 2/20 0.45
TDP1 Q9NUW8 1/20 0.41
HTT P42858 2/20 0.41
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 1/20 0.39
PTGS1 P23219 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL7325882 0.81 MEN1 (0.40) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL7326746 0.79 MAPT (0.45) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL11449832 0.76 MAPT (0.72) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL25433738 0.74 MAPT (0.50) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL14132597 0.74 ADORA2A (0.54) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL7316296 0.72 MAPT (0.43) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL28406778 0.72 PIK3CA (0.46) MAPTPOLBPTGS1
SCHEMBL7325706 0.72 MAPT (0.43) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL17673873 0.72 RAB9A (0.51) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL7318896 0.71 MAPT (0.47) MAPTKMT2AMEN1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010044445-A1 AZOLE INHIBITORS OF CYTOKINE PRODUCTION ABBOTT LABORATORIES 2001-11-22 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 (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-20010044445-A1 AZOLE INHIBITORS OF CYTOKINE PRODUCTION IL5, IL2, IL4 MAPT 2674/4885KMT2A 3552/4885MEN1 1025/4885

“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.