SCHEMBL3299063

SCHEMBL3299063

CC(C)c1ccc(COc2cc([N+](=O)[O-])ccc2N)cc1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 17/20 0.66
HTT P42858 1/20 0.52
MEN1 O00255 2/20 0.47
MAPT P10636 2/20 0.47
KMT2A Q03164 2/20 0.47
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL3295922 0.85 CYP19A1 (0.64) CYP19A1HTTMEN1MAPTKMT2A
SCHEMBL3295755 0.85 CYP19A1 (0.62) CYP19A1HTTMEN1MAPTKMT2A
SCHEMBL3297532 0.83 CYP19A1 (0.65) CYP19A1HTTMEN1MAPTKMT2A
SCHEMBL3297599 0.82 CYP19A1 (0.62) CYP19A1HTTMEN1MAPTKMT2A
SCHEMBL3295745 0.82 CYP19A1 (0.62) CYP19A1HTTMEN1MAPTKMT2A
SCHEMBL3298587 0.82 MEN1 (0.63) CYP19A1HTTMEN1MAPTKMT2A
SCHEMBL3295685 0.80 CYP19A1 (0.64) CYP19A1HTTMEN1MAPTKMT2A
SCHEMBL3295921 0.80 CYP19A1 (1.00) CYP19A1
SCHEMBL19237534 0.79 MAOB (0.63) CYP19A1MEN1MAPTKMT2ANPC1
SCHEMBL3299637 0.79 CYP19A1 (0.83) CYP19A1

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-7741520-B2 Sulfonanilide analogs as selective aromatase modulators (SAMs) THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2010-06-22 US disclosed
EP-1984325-A2 SULFONANILIDE ANALOGS AS SELECTIVE AROMATASE MODULATORS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2008-10-29 EP disclosed
US-20080045598-A1 Novel sulfonanilide analogs as selective aromatase modulators (SAMs) THE OHIO STATE UNIVERSITY (US) 2008-02-21 US disclosed
WO-2007120379-A2 SULFONANILIDE ANALOGS AS SELECTIVE AROMATASE MODULATORS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2007-10-25 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-20080045598-A1 Novel sulfonanilide analogs as selective aromatase modulators (SAMs) CYP19A1, AR, SULT2A1 CYP19A1 1/4885HTT 3747/4885MEN1 3204/4885

“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.