Sugi Predict

Sugi Predict / Compounds / SCHEMBL422893

SCHEMBL422893

SCHEMBL422893

CC(=O)Nc1ccc(F)cc1Br

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.58
▸ CA2 P00918 2/20 0.58
▸ CA9 Q16790 2/20 0.58
▸ RXFP1 Q9HBX9 3/20 0.50
▸ HDAC1 Q13547 3/20 0.50
▸ HDAC6 Q9UBN7 1/20 0.50
▸ NPC1 O15118 3/20 0.49
▸ RAB9A P51151 3/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ POLB P06746 2/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ GAA P10253 2/20 0.48
▸ ALDH1A1 P00352 4/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ MAPT P10636 3/20 0.47
▸ PKM P14618 2/20 0.47
▸ HDAC3 O15379 1/20 0.47
▸ HDAC2 Q92769 1/20 0.47

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
SCHEMBL30559973 1.00 CA1 (0.58) CA1CA2CA9RXFP1HDAC1
SCHEMBL1116454 0.87 CA1 (0.47) CA1CA2CA9RXFP1HDAC1
SCHEMBL375020 0.85 RXFP1 (0.50) CA1CA2CA9RXFP1HDAC1
SCHEMBL30005976 0.85 RXFP1 (0.50) CA1CA2CA9RXFP1HDAC1
SCHEMBL17938258 0.85 HTT (0.53) CA1CA2CA9RXFP1NPC1
SCHEMBL3909893 0.83 NPC1 (0.51) CA1CA2CA9RXFP1HDAC1
SCHEMBL1116483 0.83 ALDH1A1 (0.52) CA1CA2CA9RXFP1NPC1
SCHEMBL23997341 0.82 HPGD (0.51) CA1CA2CA9RXFP1NPC1
SCHEMBL30336857 0.82 HPGD (0.51) CA1CA2CA9RXFP1NPC1
SCHEMBL29025602 0.82 NPC1 (0.44) CA1CA2CA9RXFP1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113912534-B Biphenyl heterocyclic compound, synthesis method and application thereof 江苏科技大学 2023-07-25 — — CN claimed
CN-111217718-B Sulfur-free 2-bromo-4-fluoroacetanilide synthesis method 安徽东健化工科技有限公司 2023-06-16 — — CN claimed
WO-2023083161-A1 BIPHENYL HETEROCYCLIC COMPOUND, AND SYNTHESIS METHOD THEREFOR AND USE THEREOF 江苏科技大学 2023-05-19 — — WO claimed
CN-114441584-A Analysis method for content of acetate in lithium electrolyte 中船(邯郸)派瑞特种气体股份有限公司 2022-05-06 — — CN claimed
CN-114163346-A Synthesis method of o-bromo-p-fluoroacetanilide 宁夏常晟药业有限公司 2022-03-11 — — CN claimed
CN-113912534-A Biphenyl heterocyclic compound, and synthesis method and application thereof 江苏科技大学 2022-01-11 — — CN claimed
CN-111217718-A Synthesis method of sulfur-free 2-bromo-4-fluoroacetanilide 安徽东健化工科技有限公司 2020-06-02 — — CN claimed
CN-108440312-B Preparation method of 2- (3,4) -dichlorophenyl-4-fluoroaniline 江苏科技大学 2020-05-01 — — 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
CN-102320987-A Preparation method of 2-bromo-4-fluoroacetanilide ANHUI DONGJIAN CHEMICAL INDUSTRY CO LTD 2012-01-18 — — CN claimed
CN-102295572-A Design method for industrial process of 2-bromine-4-fluoroacetanilide — 2011-12-28 — — CN claimed
CN-102120723-A Preparation method of 2-br-4-fluoacetanilide JINKAI LIAONING CHEMICAL CO LTD 2011-07-13 — — 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 (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-20110105796-A1 Tetraarylborate Process for the Preparation of Substituted Biphenyls AHR, DDT, CYP4F3 CA1 4783/4885CA2 4722/4885CA9 3146/4885
US-20180093942-A1 PROCESS FOR PREPARING CHLORINATED BIPHENYLANILIDES AND BIPHENYLANILINES DDT, CBR3, MSRB3 CA1 2749/4885CA2 1852/4885CA9 1878/4885
US-20110092736-A1 Process for Preparing Substituted Biphenylanilides CYP1B1, DDT, ABL1 CA1 4128/4885CA2 4289/4885CA9 3282/4885

“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.