SCHEMBL8293198

SCHEMBL8293198

CCc1ccc(-c2ccccc2-c2nn[nH]n2)cc1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.71
MEN1 O00255 1/20 0.62
ALDH1A1 P00352 1/20 0.62
KMT2A Q03164 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
PDE4A P27815 4/20 0.62
PDE4B Q07343 4/20 0.62
PDE4C Q08493 4/20 0.62
PDE4D Q08499 4/20 0.62
PDE3B Q13370 4/20 0.62
PDE3A Q14432 4/20 0.62
AGTR1 P30556 8/20 0.62
AGTR2 P50052 8/20 0.62
PDE7A Q13946 1/20 0.58
PDE7B Q9NP56 1/20 0.58
GP6 Q9HCN6 1/20 0.58

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
SCHEMBL7348851 0.86 MEN1 (0.65) MEN1ALDH1A1KMT2AL3MBTL1PDE4A
SCHEMBL8451192 0.84 MEN1 (0.62) MEN1ALDH1A1KMT2AL3MBTL1PDE4A
SCHEMBL13287249 0.84 MEN1 (0.57) MEN1ALDH1A1KMT2AL3MBTL1PDE4A
SCHEMBL1344194 0.83 TP53 (1.00) TP53ALDH1A1
Methylbiphenyl Tetrazole SCHEMBL8171721 0.82 MEN1 (0.69) MEN1ALDH1A1KMT2AL3MBTL1AGTR1
SCHEMBL23512757 0.82 TP53 (0.96) TP53ALDH1A1PDE7APDE7B
SCHEMBL30153550 0.81 MEN1 (0.80) MEN1ALDH1A1KMT2AL3MBTL1GP6
SCHEMBL8783081 0.81 MEN1 (0.80) MEN1ALDH1A1KMT2AL3MBTL1GP6
SCHEMBL20552361 0.79 KCNK18 (0.57) TP53MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL8171724 0.78 XDH (0.69) MEN1ALDH1A1KMT2AL3MBTL1GP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7943647-B2 Process for the preparation of tetrazole derivatives from organo aluminium azides NOVARTIS AG (CH) 2011-05-17 US disclosed
US-7728024-B2 Metal salts of 2′-(1H-Tetrazol-5yl)-1.1′-biphenyl-4-carboxaldehyde NOVARTIS AG (CH) 2010-06-01 US disclosed
EP-1646636-B1 PROCESS FOR THE PREPARATION OF TETRAZOLE DERIVATIVES FROM ORGANO BORON AND ORGANO ALUMINIUM AZIDES NOVARTIS AG (CH) 2009-12-02 EP disclosed
US-20080234490-A1 Metal Salts of 2' - (1H-Tetrazol-5Yl) -1. 1'-Biphenyl-4-Carboxaldehyde NOVARTIS PHARMACEUTICALS CORPORATION 2008-09-25 US disclosed
US-20080119657-A1 PHENYLTETRAZOLE COMPOUNDS DIPHARMA S. P. A. (IT) 2008-05-22 US disclosed
US-7345072-B2 Phenyltetrazole compounds DIPHARMA S.P.A. (IT) 2008-03-18 US disclosed
US-20070043098-A1 Process for the preparation of tetrazole derivatives from organo boron and organo aluminium azides NOVARTIS PHARMACEUTICALS CORPORATION 2007-02-22 US disclosed
WO-2005014602-A1 PROCESS FOR THE PREPARATION OF TETRAZOLE DERIVATIVES FROM ORGANO BORON AND ORGANO ALUMINIUM AZIDES NOVARTIS AG (CH) 2005-02-17 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 (3 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-20070043098-A1 Process for the preparation of tetrazole derivatives from organo boron and organo aluminium azides ABL1, TBCA, TBC1D5 TP53 3193/4885MEN1 484/4885ALDH1A1 3205/4885
US-20080119657-A1 PHENYLTETRAZOLE COMPOUNDS ACE, AGTR2, ACE2 TP53 3287/4885MEN1 4173/4885ALDH1A1 1607/4885
US-20080234490-A1 Metal Salts of 2' - (1H-Tetrazol-5Yl) -1. 1'-Biphenyl-4-Carboxaldehyde REN, AGT, AGTR1 TP53 4415/4885MEN1 313/4885ALDH1A1 315/4885

“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.