SCHEMBL300031

SCHEMBL300031

O=C1C=CC(=O)C(Br)=C1Br

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.37
MAOB P27338 3/20 0.37
CDC25B P30305 2/20 0.37
IDO1 P14902 1/20 0.37
AKT1 P31749 1/20 0.37
SNCA P37840 1/20 0.37
MAP2K1 Q02750 1/20 0.37
PIN1 Q13526 1/20 0.37
EHMT2 Q96KQ7 1/20 0.37
NSD1 Q96L73 1/20 0.37
EHMT1 Q9H9B1 1/20 0.37
ALDH1A1 P00352 3/20 0.33
RECQL P46063 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
MAPK1 P28482 2/20 0.33
BLM P54132 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33

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
SCHEMBL3932728 0.82 IDO1 (0.32) MAOAMAOBCDC25BIDO1AKT1
SCHEMBL16994965 0.82 MEN1 (0.31) MAOAMAOBALDH1A1RECQLTDP1
SCHEMBL12819407 0.77 AURKA (0.36) ALDH1A1HSD17B10HPGDALOX12AURKA
SCHEMBL4804406 0.77 NPC1 (0.36) ALDH1A1MAPTPOLB
SCHEMBL7598298 0.71 TP53 (0.36) MAPK1BLMMAPTCASP1TP53
SCHEMBL783397 0.65
SCHEMBL2523345 0.65
SCHEMBL28663382 0.65 CDC25B (0.46) MAOAMAOBCDC25BIDO1AKT1
SCHEMBL14830262 0.63
SCHEMBL14256585 0.58

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11761954-B2 NBOMe test UNIVERSITY OF TECHNOLOGY SYDNEY 2023-09-19 US claimed
US-20220057417-A1 METHOD FOR QUALITATIVE AND/OR QUANTITATIVE DETECTION OF SUBSTANCES CONTAINED IN A HEMP PLANT AND KIT FOR USE THEREIN LUXCAN INNOVATION S.A. (LU) 2022-02-24 US claimed
EP-3908132-A1 METHOD FOR QUALITATIVELY AND/OR QUANTITATIVELY DETECTING SUBSTANCES CONTAINED IN A HEMP PLANT AND KIT FOR USE THEREIN Schmitt, Fritz (LU) 2021-11-17 EP claimed
US-20210190766-A1 NBOMe Test UNIVERSITY OF TECHNOLOGY SYDNEY (AU) 2021-06-24 US claimed
WO-2020143862-A1 METHOD FOR QUALITATIVELY AND/OR QUANTITATIVELY DETECTING SUBSTANCES CONTAINED IN A HEMP PLANT AND KIT FOR USE THEREIN Nuuvera Deutschland GmbH (DE) 2020-07-16 WO claimed
US-10174204-B2 Method for preparation of carbon quantum dots and application INSTITUTE OF PROCESS ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2019-01-08 US claimed
US-20170152141-A1 METHOD FOR PREPARING HETEROGENEOUS METAL-FREE FENTON CATALYST AND APPLICATION INSTITUTE OF PROCESS ENGINEERING CHINESE ACADEMY OF SCIENCES 2017-06-01 US claimed
US-20170152385-A1 METHOD FOR PREPARATION OF CARBON QUANTUM DOTS AND APPLICATION INSTITUTE OF PROCESS ENGINEERING, CHINESE ACADEMY OF SCIENCES 2017-06-01 US claimed
EP-3841085-B1 NBOME TEST UNIV SYDNEY TECHNOLOGY (AU) 2026-05-06 EP disclosed
US-12162980-B2 Quinone-containing poly(arylene), methods for the manufacture thereof, and use for electrochemical gas separation VERDOX, INC. (US) 2024-12-10 US disclosed
CN-118566391-A Brominated pollutant based on liquid chromatography-mass spectrometry and metabolite multi-strategy annotation method thereof 浙江大学 2024-08-30 CN disclosed
US-20230374197-A1 QUINONE-CONTAINING POLY(ARYLENE), METHODS FOR THE MANUFACTURE THEREOF, AND USE FOR ELECTROCHEMICAL GAS SEPARATION VERDOX, INC. 2023-11-23 US disclosed
CN-116867833-A Quinone-containing poly (arylene), method for the production thereof, and use for electrochemical gas separation 沃道克斯公司 2023-10-10 CN disclosed
US-11773209-B2 Quinone-containing poly(arylene), methods for the manufacture thereof, and use for electrochemical gas separation VERDOX, INC (US) 2023-10-03 US disclosed
WO-2007059610-A1 2-(PHENYL OR HETEROCYCLIC)-1H-PHENANTRHO[9,10-D]IMIDAZOLES AS MPGES-1 INHIBITORS MERCK FROSST CANADA LTD. (CA) 2007-05-31 WO disclosed
US-20070110726-A1 Rust disease control by Aphanocladium album and/or Beauveria brongniartii PHYTOMYCO RESEARCH CORPORATION (US) 2007-05-17 US disclosed
WO-2006063466-A1 2-(PHENYL OR HETEROCYCLIC)-1H-PHENANTRHO[9,10-D]IMIDAZOLES AS MPGES-1 INHIBITORS MERCK FROSST CANADA LTD. (CA) 2006-06-22 WO disclosed
EP-0753793-B1 Photographic silver halide developer composition IMATION CORP (US) 1999-11-17 EP disclosed
EP-0259040-A1 Electroconductive polydiacetylene HITACHI, LTD. (JP) 1988-03-09 EP disclosed
US-3933777-A Method for preparing polyalkenamers BABITSKY BORIS DAVIDOVICH 1976-01-20 US 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 (1 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-20070110726-A1 Rust disease control by Aphanocladium album and/or Beauveria brongniartii ERG28, HLA-A, GET3 MAOA 2843/4885MAOB 2302/4885CDC25B 1718/4885

“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.