SCHEMBL3396598

SCHEMBL3396598

Cc1ccc(Br)c(C)c1Br

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TDP2 O95551 1/20 0.33
NSD2 O96028 1/20 0.33
HSP90AA1 P07900 1/20 0.33
PAX8 Q06710 1/20 0.33
NCEH1 Q6PIU2 1/20 0.31
POLB P06746 1/20 0.31
CYP1A2 P05177 1/20 0.30

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
SCHEMBL30499370 1.00 ALDH1A1 (0.39) ALDH1A1TDP2NSD2HSP90AA1PAX8
SCHEMBL10753626 0.81 NCEH1 (0.42) ALDH1A1TDP2NSD2HSP90AA1PAX8
SCHEMBL338060 0.81 ALDH1A1 (0.36) ALDH1A1
SCHEMBL338178 0.79 ALDH1A1 (0.41) ALDH1A1CYP1A2
SCHEMBL1023210 0.79 ALDH1A1 (0.41) ALDH1A1TDP2NSD2HSP90AA1PAX8
SCHEMBL819186 0.77 ALDH1A1 (0.42) ALDH1A1NCEH1POLBCYP1A2
SCHEMBL31668870 0.77 ALDH1A1 (0.42) ALDH1A1NCEH1POLBCYP1A2
SCHEMBL29380074 0.77 ALDH1A1 (0.42) ALDH1A1HSP90AA1
SCHEMBL1590024 0.77 ALDH1A1 (0.42) ALDH1A1HSP90AA1
Ammonia Solution, Strong SCHEMBL3863207 0.77 ALDH1A1 (0.39) ALDH1A1TDP2NSD2HSP90AA1PAX8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016148649-A1 FUNCTIONALIZED QUATERNARY AMMONIUM HALIDES AND USE THEREOF AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2016-09-22 WO claimed
EP-2627172-A1 AN ANTIMICROBIAL COMPOSITION Agency For Science, Technology And Research (SG) 2013-08-21 EP claimed
US-20130210881-A1 ANTIMICROBIAL COMPOSITION AGENCY FOR SCIENCE ,TECHNOLOGY AND RESEARCH (SG) 2013-08-15 US claimed
WO-2012050531-A1 AN ANTIMICROBIAL COMPOSITION AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2012-04-19 WO claimed
JP-2007502342-A 2007-02-08 JP claimed
EP-1664167-A4 THE POLYELECTROLYTE COMPOSITION FOR HUMIDITY SENSER, POLYELECTROLYTE INK AND PREPARATION METHOD OF POLYELECTROLYTE MEMBRANE FOR SENSOR BY INKJET PRINTING HAEUN CHEMTEC CO LTD (KR) 2006-09-20 EP claimed
EP-1664167-A1 THE POLYELECTROLYTE COMPOSITION FOR HUMIDITY SENSER, POLYELECTROLYTE INK AND PREPARATION METHOD OF POLYELECTROLYTE MEMBRANE FOR SENSOR BY INKJET PRINTING Haeun Chemtec Co. Ltd. (KR) 2006-06-07 EP claimed
WO-2005014700-A1 THE POLYELECTROLYTE COMPOSITION FOR HUMIDITY SENSER, POLYELECTROLYTE INK AND PREPARATION METHOD OF POLYELECTROLYTE MEMBRANE FOR SENSOR BY INKJET PRINTING HAEUN CHEMTEC CO., LTD. (KR) 2005-02-17 WO claimed
JP-55054381-A None JP disclosed
CN-121045338-B Cyclic peptide targeting CAIX and preparation method and application thereof 原子高科股份有限公司 2026-05-19 CN disclosed
CN-122056129-A Method for manufacturing semiconductor device 株式会社力森诺科 2026-05-15 CN disclosed
US-20260126453-A1 Mass Spectrometry Kit Including a Cross-linked Antibody or Fragment Thereof THE BINDING SITE GROUP LTD (GB) 2026-05-07 US disclosed
EP-4675278-A2 ASSAY FOR PLASMA CELL ASSOCIATED DISEASE The Binding Site Group Limited (GB) 2026-01-07 EP disclosed
US-12461108-B2 Mass spectrometry kit including a cross-linked antibody or fragment thereof THE BINDING SITE GROUP LIMITED (GB) 2025-11-04 US disclosed
EP-0448078-A2 Substituted amine derivatives having anti-hyperlipemia activity BANYU PHARMACEUTICAL CO., LTD. (JP) 1991-09-25 EP disclosed
WO-1991009848-A1 PYRIDINONES USEFUL AS ANTIATHEROSCLEROTIC AGENTS THE UPJOHN COMPANY (US) 1991-07-11 WO disclosed
WO-1991006626-A2 TRIPLE HELIX FORMATION IN OLIGONUCLEOTIDE THERAPY GILEAD SCIENCES, INC. (US) 1991-05-16 WO disclosed
EP-0387769-A1 Toner containing a diarylguanidine type compound for developing electrostatic images CANON KABUSHIKI KAISHA (JP) 1990-09-19 EP disclosed
EP-0010896-B1 ORGANIC DIAMINE COMPOUNDS FOR USE AS ORAL HYPOGLYCEMIC AGENTS AND PHARMACEUTICAL COMPOSITIONS THEREOF PFIZER INC. (US) 1981-12-30 EP disclosed
JP-S5554381-A ELECTROCHROMIC MATERIAL FOR DISPLAY DEVICE HITACHI LTD 1980-04-21 JP 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 (2 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-20260126453-A1 Mass Spectrometry Kit Including a Cross-linked Antibody or Fragment Thereof IGLV6-57, IGSF11, FCGR3B ALDH1A1 2401/4885TDP2 3693/4885NSD2 2870/4885
US-20130210881-A1 ANTIMICROBIAL COMPOSITION NOD2, MPO, NACA ALDH1A1 4221/4885TDP2 2299/4885NSD2 3761/4885

“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.