SCHEMBL4756919

SCHEMBL4756919

O=Cc1cc(Br)c(O)c(C(=O)O)c1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.69
PTPN6 P29350 4/20 0.69
PTPN2 P17706 3/20 0.69
AKR1C3 P42330 3/20 0.60
AKR1C2 P52895 3/20 0.60
AKR1C1 Q04828 3/20 0.60
AKR1C4 P17516 2/20 0.60
TTR P02766 1/20 0.45
APP P05067 4/20 0.45
PIM1 P11309 1/20 0.42
ERN1 O75460 2/20 0.41

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
SCHEMBL31497642 1.00 PTPN1 (0.69) PTPN1PTPN6PTPN2AKR1C3AKR1C2
SCHEMBL4756917 0.83 ERN1 (0.50) PTPN1PTPN6PTPN2AKR1C3AKR1C2
SCHEMBL373244 0.81 ERN1 (0.52) PTPN1PTPN6PTPN2TTRERN1
SCHEMBL5463920 0.80 PTPN1 (0.50) PTPN1PTPN6PTPN2PIM1
SCHEMBL7767550 0.79 PTPN1 (0.45) PTPN1PTPN6PTPN2AKR1C3AKR1C2
SCHEMBL2511971 0.79 PTPN1 (0.45) PTPN1PTPN6PTPN2ERN1
SCHEMBL10763255 0.77 PTPN1 (0.46) PTPN1PTPN6PTPN2AKR1C3AKR1C2
SCHEMBL1984171 0.77 HMGB1 (0.55) PTPN1PTPN6PTPN2TTR
SCHEMBL5777093 0.77 APP (0.45) PTPN1PTPN6PTPN2AKR1C3AKR1C2
SCHEMBL330545 0.75 AKR1C3 (1.00) PTPN1PTPN6PTPN2AKR1C3AKR1C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1879661-A1 AGENT FOR DYEING KERATIN-BASED FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-01-23 EP claimed
WO-2006119821-A1 AGENT FOR DYEING KERATIN-BASED FIBRES HENKEL KOMMANDITGESELLCHAFT AUF AKTIEN (DE) 2006-11-16 WO claimed
CN-119462555-A Sulfonamide compound and application thereof 上海科技大学 2025-02-18 CN disclosed
US-10980890-B2 Compounds comprising self-immolative group LEGOCHEM BIOSCIENCES, INC. (KR) 2021-04-20 US disclosed
CN-107648613-B Compounds comprising self-immolative groups 乐高化学生物科学股份有限公司 2020-04-10 CN disclosed
US-20200069816-A1 COMPOUNDS COMPRISING SELF-IMMOLATIVE GROUP LIGACHEM BIOSCIENCES INC. (KR) 2020-03-05 US disclosed
US-10383949-B2 Compounds comprising self-immolative group LEGOCHEM BIOSCIENCES, INC. (KR) 2019-08-20 US disclosed
US-10183997-B2 Compositions and methods related to anti-CD19 antibody drug conjugates LEGOCHEM BIOSCIENCES, INC. (KR) 2019-01-22 US disclosed
US-20180353611-A1 COMPOUNDS COMPRISING SELF-IMMOLATIVE GROUP LIGACHEM BIOSCIENCES INC. (KR) 2018-12-13 US disclosed
US-10118965-B2 Compositions and methods related to anti-EGFR antibody drug conjugates LEGOCHEM BIOSCIENCES, INC. (KR) 2018-11-06 US disclosed
US-9993568-B2 Compounds comprising self-immolative group LEGOCHEM BIOSCIENCES, INC. (KR) 2018-06-12 US disclosed
US-20170088621-A1 COMPOSITIONS AND METHODS RELATED TO ANTI-EGFR ANTIBODY DRUG CONJUGATES LEGOCHEM BIOSCIENCES, INC. (KR) 2017-03-30 US disclosed
WO-2017051249-A1 COMPOSITIONS AND METHODS RELATED TO ANTI-CD19 ANTIBODY DRUG CONJUGATES LEGOCHEM BIOSCIENCES, INC. (KR) 2017-03-30 WO disclosed
US-20170088614-A1 COMPOSITIONS AND METHODS RELATED TO ANTI-CD19 ANTIBODY DRUG CONJUGATES LEGOCHEM BIOSCIENCES, INC. (KR) 2017-03-30 US disclosed
WO-2017051249-A1 COMPOSITIONS AND METHODS RELATED TO ANTI-CD19 ANTIBODY DRUG CONJUGATES LEGOCHEM BIOSCIENCES, INC. (KR) 2017-03-30 WO disclosed
WO-2017051254-A1 COMPOSITIONS AND METHODS RELATED TO ANTI-EGFR ANTIBODY DRUG CONJUGATES LEGOCHEM BIOSCIENCES, INC. (KR) 2017-03-30 WO disclosed
US-20160184451-A1 COMPOUNDS COMPRISING SELF-IMMOLATIVE GROUP LIGACHEM BIOSCIENCES INC. (KR) 2016-06-30 US disclosed
US-20160184451-A1 COMPOUNDS COMPRISING SELF-IMMOLATIVE GROUP LIGACHEM BIOSCIENCES INC. (KR) 2016-06-30 US disclosed
US-20160184451-A1 COMPOUNDS COMPRISING SELF-IMMOLATIVE GROUP LIGACHEM BIOSCIENCES INC. (KR) 2016-06-30 US disclosed
WO-2015182984-A1 COMPOUND CONTAINING SELF-IMMOLATIVE GROUP 주식회사 레고켐 바이오사이언스 2015-12-03 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 (9 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-10183997-B2 Compositions and methods related to anti-CD19 antibody drug conjugates CD47, CD22, BCL6 PTPN1 447/4885PTPN6 400/4885PTPN2 461/4885
US-20200069816-A1 COMPOUNDS COMPRISING SELF-IMMOLATIVE GROUP IAPP, IDE, DNPEP PTPN1 1207/4885PTPN6 1052/4885PTPN2 1062/4885
US-10383949-B2 Compounds comprising self-immolative group IAPP, IDE, DNPEP PTPN1 1255/4885PTPN6 1057/4885PTPN2 1133/4885
US-20180353611-A1 COMPOUNDS COMPRISING SELF-IMMOLATIVE GROUP IAPP, IDE, DNPEP PTPN1 1255/4885PTPN6 1057/4885PTPN2 1133/4885
US-20170088621-A1 COMPOSITIONS AND METHODS RELATED TO ANTI-EGFR ANTIBODY DRUG CONJUGATES EGFR, ERBB2, ERBB3 PTPN1 336/4885PTPN6 240/4885PTPN2 375/4885
US-20160184451-A1 COMPOUNDS COMPRISING SELF-IMMOLATIVE GROUP IAPP, IDE, DNPEP PTPN1 1255/4885PTPN6 1057/4885PTPN2 1133/4885
US-10980890-B2 Compounds comprising self-immolative group IAPP, IDE, DNPEP PTPN1 1207/4885PTPN6 1052/4885PTPN2 1062/4885
US-20170088614-A1 COMPOSITIONS AND METHODS RELATED TO ANTI-CD19 ANTIBODY DRUG CONJUGATES CD47, CD22, BCL6 PTPN1 447/4885PTPN6 400/4885PTPN2 461/4885
US-10118965-B2 Compositions and methods related to anti-EGFR antibody drug conjugates EGFR, ERBB2, ERBB3 PTPN1 336/4885PTPN6 240/4885PTPN2 375/4885

“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.