SCHEMBL1017795

SCHEMBL1017795

O=C(Nc1ccccc1)c1ccccc1-c1ccccc1C(=O)Nc1ccccc1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.89
CYP2C9 P11712 1/20 0.89
ALOX12 P18054 1/20 0.89
CHRNB2 P17787 1/20 0.81
CHRNB4 P30926 1/20 0.81
CHRNA3 P32297 1/20 0.81
CHRNA4 P43681 1/20 0.81
ALDH1A1 P00352 4/20 0.70
MEN1 O00255 3/20 0.68
KMT2A Q03164 3/20 0.68
HTT P42858 3/20 0.68
HPGD P15428 2/20 0.68
LMNA P02545 2/20 0.68
KDM4E B2RXH2 1/20 0.68
TP53 P04637 1/20 0.68
HSD17B10 Q99714 1/20 0.68
TDP1 Q9NUW8 1/20 0.66
BCAT2 O15382 1/20 0.65
METAP2 P50579 1/20 0.63
GAA P10253 2/20 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
SCHEMBL31252862 0.91 CYP3A4 (0.74) CYP3A4CYP2C9ALOX12CHRNB2CHRNB4
SCHEMBL28052587 0.91 CYP3A4 (0.74) CYP3A4CYP2C9ALOX12CHRNB2CHRNB4
SCHEMBL28669297 0.91 CYP3A4 (0.74) CYP3A4CYP2C9ALOX12CHRNB2CHRNB4
SCHEMBL1017796 0.90 CHRNB2 (1.00) CYP3A4CYP2C9ALOX12CHRNB2CHRNB4
SCHEMBL14933472 0.89 CYP3A4 (0.72) CYP3A4CYP2C9ALOX12CHRNB2CHRNB4
SCHEMBL437231 0.89 ALDH1A1 (0.87) CYP3A4CYP2C9ALOX12CHRNB2CHRNB4
Hydrochloric Acid SCHEMBL29598779 0.88 CHRNB2 (0.96) CYP3A4CYP2C9ALOX12CHRNB2CHRNB4
SCHEMBL25148550 0.88 CYP3A4 (0.70) CYP3A4CYP2C9ALOX12CHRNB2CHRNB4
SCHEMBL11266259 0.86 ALDH1A1 (0.83) CYP3A4CYP2C9ALOX12CHRNB2CHRNB4
SCHEMBL11266257 0.86 ALDH1A1 (0.83) CYP3A4CYP2C9ALOX12CHRNB2CHRNB4

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 105 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-2280932-A1 PROCESS FOR PREPARING SUBSTITUTED BIPHENYLANILIDES Bayer CropScience AG (DE) 2011-02-09 EP claimed
US-20110003999-A1 Process for Preparing Substituted Biphenylanilides BAYER CROPSCIENCE AG (DE) 2011-01-06 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
JP-61014258-A None JP disclosed
JP-S6114258-A RESIN COMPOSITION HAVING IMPROVED MOLDABILITY MITSUBISHI PETROCHEM CO LTD 1986-01-22 JP disclosed
EP-0162663-A2 Process for producing heat-resistant moldings MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1985-11-27 EP 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 (4 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 CYP3A4 705/4885CYP2C9 554/4885ALOX12 4055/4885
US-20160280635-A1 IMPROVED PROCESS FOR PREPARING CHLORINATED BIPHENYLANILIDES AND BIPHENYLANILINES CYP2F1, CYP1A1, CYP4F12 CYP3A4 13/4885CYP2C9 11/4885ALOX12 3464/4885
US-20110003999-A1 Process for Preparing Substituted Biphenylanilides DDT, PAH, THOP1 CYP3A4 69/4885CYP2C9 55/4885ALOX12 2536/4885
US-20110092736-A1 Process for Preparing Substituted Biphenylanilides CYP1B1, DDT, ABL1 CYP3A4 36/4885CYP2C9 108/4885ALOX12 2997/4885

“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.