SCHEMBL6155288

SCHEMBL6155288

O=[N+]([O-])C1(Br)C=CC(c2ccccc2)C=C1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNA4 P22459 1/20 0.45
KCNA1 Q09470 1/20 0.45
KCNAB1 Q14722 1/20 0.45
DNMT3B Q9UBC3 1/20 0.39
MEN1 O00255 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.33
FBP1 P09467 1/20 0.30

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
SCHEMBL8655835 0.81 KCNA4 (0.40) KCNA4KCNA1KCNAB1DNMT3BMEN1
SCHEMBL5983432 0.79 KCNA4 (0.38) KCNA4KCNA1KCNAB1DNMT3BMEN1
SCHEMBL2422556 0.79 KCNA4 (0.38) KCNA4KCNA1KCNAB1DNMT3BMEN1
Bicarbonate SCHEMBL21906198 0.77 KCNA4 (0.37) KCNA4KCNA1KCNAB1DNMT3BMEN1
SCHEMBL3389675 0.76 KCNA4 (0.36) KCNA4KCNA1KCNAB1DNMT3BMEN1
SCHEMBL2390258 0.74 HTR2C (0.32) KCNA4KCNA1KCNAB1MEN1CYP2C19
SCHEMBL5785392 0.73 KCNA4 (0.35) KCNA4KCNA1KCNAB1DNMT3BMEN1
SCHEMBL6903379 0.73 MEN1 (0.36) KCNA4KCNA1KCNAB1DNMT3BMEN1
SCHEMBL7427186 0.72 KDM1A (0.39) MEN1CYP2C19KMT2ALMNAALDH1A1
SCHEMBL5526902 0.72 KDM1A (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101133016-B Method for producing substituted biphenyls BASF AG 2010-06-02 CN disclosed
CN-101133016-A Method for producing substituted biphenyls BASF AG (DE) 2008-02-27 CN disclosed
US-20050271584-A1 Biphenyls and fluorenes as imaging agents in alzheimer's disease THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2005-12-08 US disclosed
EP-1553985-A2 BIPHENYLS AND FLUORENES AS IMAGING AGENTS IN ALZHEIMER'S DISEASE The Trustees of The University of Pennsylvania (US) 2005-07-20 EP disclosed
CN-1163452-C Process for preparing nitrobiphenylene �����ɷ� 2004-08-25 CN disclosed
WO-2004032975-A2 BIPHENYLS AND FLUORENES AS IMAGING AGENTS IN ALZHEIMER'S DISEASE THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2004-04-22 WO disclosed
CN-1213359-A Process for preparing nitrobiphenylene BASF AG (DE) 1999-04-07 CN 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-20050271584-A1 Biphenyls and fluorenes as imaging agents in alzheimer's disease APP, BACE2, BACE1 KCNA4 3474/4885KCNA1 3206/4885KCNAB1 1784/4885

“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.