SCHEMBL6092403

SCHEMBL6092403

O=C(O)c1c(N2CCCC2=O)c2ccc(-c3ccc(OCc4ccccc4)cc3)cc2n1Cc1cccc([N+](=O)[O-])c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
EDNRB P24530 2/20 0.40
EDNRA P25101 2/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
P2RX7 Q99572 6/20 0.40
ADAMTS4 O75173 1/20 0.40
MMP13 P45452 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.40
PGR P06401 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
NOX4 Q9NPH5 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
SCHEMBL6092119 0.92 MAPT (0.42) MAPTMEN1LMNAKMT2AMAOA
SCHEMBL6092644 0.81 MAPT (0.49) MAPTMEN1LMNAKMT2AEDNRB
SCHEMBL6091749 0.75 MAPT (0.47) MAPTMEN1LMNAKMT2AMAOA
SCHEMBL6092351 0.74 SERPINE1 (0.40) LMNAEDNRBEDNRAALDH1A1
SCHEMBL12533265 0.68 MAOB (0.66) MAPTMEN1LMNAKMT2AMAOA
SCHEMBL8991408 0.66 MAOB (0.79) MAPTMEN1LMNAKMT2AMAOA
SCHEMBL6306847 0.65 KMT2A (0.55) MAPTMEN1LMNAKMT2AALDH1A1
SCHEMBL5569349 0.64 SMN1; SMN2 (0.55) MAPTLMNAMAOAMAOBMMP13
SCHEMBL6599866 0.64 MAOB (0.68) MAPTMEN1LMNAKMT2AMAOA
SCHEMBL2716224 0.63 L3MBTL1 (0.52) MAPTMEN1LMNAKMT2AALDH1A1

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-20060160879-A1 Indoles useful in the treatment of inflammation BIOLIPOX AB (SE) 2006-07-20 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-20060160879-A1 Indoles useful in the treatment of inflammation IDO1, PTGS1, IDO2 MAPT 3503/4885MEN1 3878/4885LMNA 3087/4885

“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.