SCHEMBL3875765

SCHEMBL3875765

CC(C)(CNc1c([N+](=O)[O-])cnc2cc(OCc3ccccc3)ccc12)NC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
EGLN2 Q96KS0 2/20 0.42
EGLN1 Q9GZT9 2/20 0.42
BACE1 P56817 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ATM Q13315 1/20 0.41
MAOB P27338 1/20 0.41
TDO2 P48775 1/20 0.41
KDM4E B2RXH2 1/20 0.40
AR P10275 1/20 0.40
NMT2 O60551 1/20 0.39
NMT1 P30419 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
SCHEMBL3875764 1.00 MAPT (0.44) MAPTMEN1KMT2AEGLN2EGLN1
SCHEMBL4062749 0.94 MEN1 (0.42) MAPTMEN1KMT2AEGLN2EGLN1
SCHEMBL1486808 0.93 MAPT (0.46) MAPTMEN1KMT2AEGLN2EGLN1
SCHEMBL1486807 0.93 MAPT (0.46) MAPTMEN1KMT2AEGLN2EGLN1
SCHEMBL1486584 0.91 MEN1 (0.42) MAPTMEN1KMT2AEGLN2EGLN1
SCHEMBL5618323 0.90 MAPT (0.40) MAPTMEN1KMT2AEGLN2EGLN1
SCHEMBL1486472 0.89 TDO2 (0.42) MAPTMEN1KMT2ABACE1NPC1
SCHEMBL1486475 0.88 AR (0.42) MAPTMEN1KMT2AEGLN2EGLN1
SCHEMBL1486671 0.87 MAPT (0.40) MAPTMEN1KMT2AEGLN2EGLN1
SCHEMBL1486672 0.87 MAPT (0.40) MAPTMEN1KMT2AEGLN2EGLN1

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
EP-1658076-B1 ARYLOXY AND ARYLALKYLENEOXY SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES CO (US) 2013-03-06 EP disclosed
US-20090018122-A1 Aryloxy and Arylalkyleneoxy Substituted Imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2009-01-15 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-20090018122-A1 Aryloxy and Arylalkyleneoxy Substituted Imidazoquinolines IL2, IFNG, IRF3 MAPT 4765/4885MEN1 4690/4885KMT2A 2818/4885

“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.