Sugi Predict

Sugi Predict / Compounds / SCHEMBL422636

SCHEMBL422636

SCHEMBL422636

CC(=O)Nc1ccccc1Br

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.61
▸ ALDH1A1 P00352 2/20 0.61
▸ HPGD P15428 1/20 0.61
▸ HTT P42858 4/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ NPC1 O15118 1/20 0.58
▸ LMNA P02545 1/20 0.58
▸ RAB9A P51151 1/20 0.58
▸ PDK1 Q15118 1/20 0.54
▸ PDK2 Q15119 1/20 0.54
▸ PDK3 Q15120 1/20 0.54
▸ PDK4 Q16654 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ POLB P06746 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ MAPK1 P28482 1/20 0.52
▸ EGFR P00533 1/20 0.51
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51

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
SCHEMBL29408737 1.00 RXFP1 (0.61) RXFP1ALDH1A1HPGDHTTKMT2A
SCHEMBL6689158 0.84 ALDH1A1 (0.74) RXFP1ALDH1A1HPGDHTTKMT2A
SCHEMBL6694336 0.83 RXFP1 (0.53) RXFP1ALDH1A1HPGDHTTKMT2A
SCHEMBL13235126 0.82 HTT (0.81) ALDH1A1HTTKMT2AMEN1NPC1
SCHEMBL23705971 0.82 RXFP1 (0.51) RXFP1ALDH1A1HPGDKMT2AMEN1
SCHEMBL265392 0.82 ALDH1A1 (0.55) RXFP1ALDH1A1HPGDKMT2AMEN1
SCHEMBL30881878 0.80 RXFP1 (0.80) RXFP1ALDH1A1HPGDKMT2AMEN1
SCHEMBL146375 0.80 RXFP1 (0.50) RXFP1ALDH1A1HPGDHTTKMT2A
SCHEMBL25946008 0.80 RXFP1 (0.80) RXFP1ALDH1A1HPGDKMT2AMEN1
SCHEMBL1116453 0.80 LMNA (0.58) ALDH1A1HTTKMT2AMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110305018-B Preparation method of 3-bromo-2-fluoronitrobenzene 浙江普洛家园药业有限公司 2022-07-15 — — CN claimed
CN-109082280-B Preparation method of liquid crystal material 宁夏中星显示材料有限公司 2020-07-28 — — CN claimed
CN-110305018-A A kind of preparation method of the bromo- 2- fluoronitrobenzene of 3- 浙江普洛家园药业有限公司 2019-10-08 — — CN claimed
CN-109082280-A A kind of preparation method of liquid crystal material 宁夏中星显示材料有限公司 2018-12-25 — — CN claimed
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
US-8436211-B2 Tetraarylborate process for the preparation of substituted biphenyls BAYER CROPSCIENCE AG (DE) 2013-05-07 — — US claimed
EP-2473476-A1 TETRAARYLBORATE PROCESS FOR PRODUCING SUBSTITUTED BIPHENYLS Bayer CropScience AG (DE) 2012-07-11 — — EP claimed
CN-102482195-A Tetraarylborate process for preparing substituted biphenyls BAYER CROPSCIENCE AG 2012-05-30 — — CN claimed
US-20110105796-A1 Tetraarylborate Process for the Preparation of Substituted Biphenyls BAYER CROPSCIENCE AG (DE) 2011-05-05 — — US claimed
US-20110092736-A1 Process for Preparing Substituted Biphenylanilides BAYER CROPSCIENCE AG (DE) 2011-04-21 — — US claimed
CN-102015625-A Process for preparing substituted biphenylanilides BAYER CROPSCIENCE AG 2011-04-13 — — CN claimed
WO-2011023324-A1 TETRAARYLBORATE PROCESS FOR PRODUCING SUBSTITUTED BIPHENYLS BAYER CROPSCIENCE AG (DE) 2011-03-03 — — WO claimed
EP-2280932-A1 PROCESS FOR PREPARING SUBSTITUTED BIPHENYLANILIDES Bayer CropScience AG (DE) 2011-02-09 — — 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

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-20110105796-A1 Tetraarylborate Process for the Preparation of Substituted Biphenyls AHR, DDT, CYP4F3 RXFP1 4797/4885ALDH1A1 704/4885HPGD 4331/4885
US-20180093942-A1 PROCESS FOR PREPARING CHLORINATED BIPHENYLANILIDES AND BIPHENYLANILINES DDT, CBR3, MSRB3 RXFP1 2949/4885ALDH1A1 3801/4885HPGD 3746/4885
US-20160280635-A1 IMPROVED PROCESS FOR PREPARING CHLORINATED BIPHENYLANILIDES AND BIPHENYLANILINES CYP2F1, CYP1A1, CYP4F12 RXFP1 4817/4885ALDH1A1 798/4885HPGD 3238/4885
US-20110092736-A1 Process for Preparing Substituted Biphenylanilides CYP1B1, DDT, ABL1 RXFP1 3791/4885ALDH1A1 916/4885HPGD 4256/4885

“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.