SCHEMBL1017796

SCHEMBL1017796

O=C(Nc1ccccc1)c1ccccc1-c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 1.00
CHRNB4 P30926 3/20 1.00
CHRNA3 P32297 3/20 1.00
CHRNA4 P43681 3/20 1.00
ALDH1A1 P00352 3/20 0.78
CYP3A4 P08684 1/20 0.73
CYP2C9 P11712 1/20 0.73
ALOX12 P18054 1/20 0.73
HTT P42858 5/20 0.71
GAA P10253 2/20 0.71
POLB P06746 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.71
TP53 P04637 2/20 0.67
KDM4E B2RXH2 2/20 0.66
LMNA P02545 2/20 0.61
MEN1 O00255 2/20 0.61
HPGD P15428 2/20 0.61
KMT2A Q03164 2/20 0.61
HSD17B10 Q99714 1/20 0.61
TDP1 Q9NUW8 1/20 0.59

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
Hydrochloric Acid SCHEMBL29598779 0.98 CHRNB2 (0.96) CHRNB2CHRNB4CHRNA3CHRNA4ALDH1A1
SCHEMBL6631304 0.94 CHRNB2 (0.89) CHRNB2CHRNB4CHRNA3CHRNA4ALDH1A1
SCHEMBL1017795 0.90 CYP3A4 (0.89) CHRNB2CHRNB4CHRNA3CHRNA4ALDH1A1
SCHEMBL29970845 0.88 CHRNB2 (0.78) CHRNB2CHRNB4CHRNA3CHRNA4ALDH1A1
SCHEMBL29201497 0.88 CHRNB2 (0.78) CHRNB2CHRNB4CHRNA3CHRNA4ALDH1A1
SCHEMBL6779138 0.88 ALDH1A1 (1.00) CHRNB2CHRNB4CHRNA3CHRNA4ALDH1A1
SCHEMBL31393753 0.88 CHRNB2 (0.78) CHRNB2CHRNB4CHRNA3CHRNA4ALDH1A1
SCHEMBL94735 0.88 CHRNB2 (0.78) CHRNB2CHRNB4CHRNA3CHRNA4ALDH1A1
SCHEMBL2571393 0.88 CHRNB2 (0.78) CHRNB2CHRNB4CHRNA3CHRNA4ALDH1A1
SCHEMBL7863451 0.88 CHRNB2 (0.78) CHRNB2CHRNB4CHRNA3CHRNA4ALDH1A1

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 138 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3024836-B1 IMPROVED METHOD FOR THE PREPARATION OF CHLORINATED BIPHENYLANILIDES AND BIPHENYLANILINES BAYER CROPSCIENCE AG (DE) 2018-07-11 EP claimed
US-20180093942-A1 PROCESS FOR PREPARING CHLORINATED BIPHENYLANILIDES AND BIPHENYLANILINES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-04-05 US claimed
US-9868694-B2 Process for preparing chlorinated biphenylanilides and biphenylanilines BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-01-16 US claimed
EP-2280932-B1 Process for preparing substituted biphenylanilides BAYER IP GMBH (DE) 2017-10-18 EP claimed
US-20160280635-A1 IMPROVED PROCESS FOR PREPARING CHLORINATED BIPHENYLANILIDES AND BIPHENYLANILINES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-09-29 US claimed
EP-3024836-A1 IMPROVED PROCESS FOR PREPARING CHLORINATED BIPHENYLANILIDES AND BIPHENYLANILINES Bayer CropScience Aktiengesellschaft (DE) 2016-06-01 EP claimed
WO-2015011032-A1 IMPROVED PROCESS FOR PREPARING CHLORINATED BIPHENYLANILIDES AND BIPHENYLANILINES BAYER CROPSCIENCE AG (DE) 2015-01-29 WO claimed
US-8455689-B2 Process for preparing substituted biphenylanilides BAYER CROPSCIENCE AG (DE) 2013-06-04 US claimed
EP-2257530-B1 PROCESS FOR PREPARING SUBSTITUTED BIPHENYLANILIDES BAYER CROPSCIENCE AG (DE) 2011-10-12 EP claimed
US-20110092736-A1 Process for Preparing Substituted Biphenylanilides BAYER CROPSCIENCE AG (DE) 2011-04-21 US claimed
EP-2257530-A1 PROCESS FOR PREPARING SUBSTITUTED BIPHENYLANILIDES Bayer CropScience Aktiengesellschaft (DE) 2010-12-08 EP claimed
EP-2119697-A1 Process for preparing substituted biphenylanilides Bayer CropScience AG (DE) 2009-11-18 EP claimed
WO-2009135598-A1 PROCESS FOR PREPARING SUBSTITUTED BIPHENYLANILIDES BAYER CROPSCIENCE AG 2009-11-12 WO claimed
WO-2009106234-A1 PROCESS FOR PREPARING SUBSTITUTED BIPHENYLANILIDES BAYER CROPSCIENCE AG (DE) 2009-09-03 WO claimed
EP-2093216-A1 Process for preparing substituted biphenylanilides Bayer CropScience AG (DE) 2009-08-26 EP claimed
CN-101336227-A Nuclear receptor binding agents GTX INC (US) 2008-12-31 CN claimed
EP-1813152-A1 Fungicidal mixture based on 3,4-disubstituted biphenylanilides BASF AKTIENGESELLSCHAFT (DE) 2007-08-01 EP claimed
EP-0620122-B1 Thermosensitive recording material NEW OJI PAPER CO LTD (JP) 1996-03-13 EP claimed
US-5446010-A Substrate sheet, thermosensitive colored image forming layer containing colorless dye precursor, binder, color developing agent having sulfonylureido group, aromatic amide sensitizer; storage stability NEW OJI PAPER CO., LTD. (JP) 1995-08-29 US claimed
EP-0620122-A1 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1994-10-19 EP claimed

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-20180093942-A1 PROCESS FOR PREPARING CHLORINATED BIPHENYLANILIDES AND BIPHENYLANILINES DDT, CBR3, MSRB3 CHRNB2 1554/4885CHRNB4 1515/4885CHRNA3 1030/4885
US-20160280635-A1 IMPROVED PROCESS FOR PREPARING CHLORINATED BIPHENYLANILIDES AND BIPHENYLANILINES CYP2F1, CYP1A1, CYP4F12 CHRNB2 3771/4885CHRNB4 3426/4885CHRNA3 3836/4885
US-20110092736-A1 Process for Preparing Substituted Biphenylanilides CYP1B1, DDT, ABL1 CHRNB2 2666/4885CHRNB4 3020/4885CHRNA3 3480/4885

“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.