SCHEMBL4133372

SCHEMBL4133372

Brc1ccc(-c2ccco2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.61
TSHR P16473 3/20 0.61
MAPT P10636 3/20 0.61
KDM4E B2RXH2 3/20 0.61
NPC1 O15118 2/20 0.61
RAB9A P51151 2/20 0.61
HSD17B10 Q99714 2/20 0.61
ALDH1A1 P00352 4/20 0.50
PIK3R1 P27986 2/20 0.47
PIK3CA P42336 2/20 0.47
LPL P06858 1/20 0.47
LIPG Q9Y5X9 1/20 0.47
GAA P10253 1/20 0.47
POLB P06746 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
USP2 O75604 1/20 0.44
LMNA P02545 1/20 0.44
THRB P10828 1/20 0.44
PKM P14618 1/20 0.44

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
SCHEMBL394300 0.87 TAAR1 (0.76) TAAR1TSHRMAPTKDM4ENPC1
Pyridine SCHEMBL29022751 0.87 KDM4E (0.54) TAAR1TSHRMAPTKDM4ENPC1
SCHEMBL30487922 0.85 TAAR1 (0.73) TAAR1TSHRMAPTKDM4ENPC1
SCHEMBL244155 0.79
SCHEMBL19661647 0.79 TAAR1 (0.48) TAAR1TSHRMAPTKDM4ENPC1
SCHEMBL19662294 0.79 TAAR1 (0.48) TAAR1TSHRMAPTKDM4ENPC1
SCHEMBL3249633 0.78 RAB9A (0.62) TAAR1TSHRMAPTKDM4ENPC1
SCHEMBL7404185 0.78 TAAR1 (0.64) TAAR1TSHRMAPTKDM4ENPC1
SCHEMBL28323221 0.77 TAAR1 (0.62) TAAR1TSHRMAPTKDM4ENPC1
SCHEMBL162083 0.77 TAAR1 (0.62) TAAR1TSHRMAPTKDM4ENPC1

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
US-11634400-B2 Micheliolide derivatives, methods for their preparation and their use as anticancer and antiinflammatory agents UNIVERSITY OF ROCHESTER (US) 2023-04-25 US claimed
US-20200277270-A1 MICHELIOLIDE DERIVATIVES, METHODS FOR THEIR PREPARATION AND THEIR USE AS ANTICANCER AND ANTIINFLAMMATORY AGENTS UNIVERSITY OF ROCHESTER 2020-09-03 US claimed
WO-2019040335-A1 MICHELIOLIDE DERIVATIVES, METHODS FOR THEIR PREPARATION AND THEIR USE AS ANTICANCER AND ANTIINFLAMMATORY AGENTS UNIVERSITY OF ROCHESTER (US) 2019-02-28 WO claimed
CN-105209449-B Inhibitors of the kynurenine pathway 库拉德夫制药私人有限公司 2019-02-01 CN claimed
US-20160115508-A1 PARTHENOLIDE DERIVATIVES, METHODS FOR THEIR PREPARATION AND THEIR USE AS ANTICANCER AGENTS NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2016-04-28 US claimed
EP-3003317-A2 PARTHENOLIDE DERIVATIVES, METHODS FOR THEIR PREPARATION AND THEIR USE AS ANTICANCER AGENTS University Of Rochester (US) 2016-04-13 EP claimed
WO-2014197591-A2 PARTHENOLIDE DERIVATIVES, METHODS FOR THEIR PREPARATION AND THEIR USE AS ANTICANCER AGENTS UNIVERSITY OF ROCHESTER (US) 2014-12-11 WO claimed
CN-119708016-A Cover layer material and high color gamut organic electroluminescent device 京东方科技集团股份有限公司 2025-03-28 CN disclosed
WO-2023224579-A1 BISMUTHENE AS A VERSATILE PHOTOCATALYST OPERATING UNDER VARIABLE CONDITIONS FOR THE PHOTOREDOX C–H BOND FUNCTIONALIZATION KOC UNIVERSITESI (TR) 2023-11-23 WO disclosed
CN-116332962-A Arylamine compound and display substrate 京东方科技集团股份有限公司 2023-06-27 CN disclosed
US-11634400-B2 Micheliolide derivatives, methods for their preparation and their use as anticancer and antiinflammatory agents UNIVERSITY OF ROCHESTER (US) 2023-04-25 US disclosed
US-20220306654-A1 MECHANOREDOX REACTION USING PIEZOELECTRIC MATERIAL, AND PRODUCTION METHOD USING SAID REACTION NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2022-09-29 US disclosed
EP-4026821-A1 MECHANOREDOX REACTION USING PIEZOELECTRIC MATERIAL, AND PRODUCTION METHOD USING SAID REACTION National University Corporation Hokkaido University (JP) 2022-07-13 EP disclosed
WO-2008040669-A2 NOVEL INTERMEDIATES FOR THE PREPARATION OF A GLYT1 INHIBITOR JANSSEN PHARMACEUTICA N.V. (BE) 2008-04-10 WO disclosed
WO-2008040669-A2 NOVEL INTERMEDIATES FOR THE PREPARATION OF A GLYT1 INHIBITOR JANSSEN PHARMACEUTICA N.V. (BE) 2008-04-10 WO disclosed
CN-1151209-A Method for detecting nucleic acid and cytoskeleton components by using double-dicationic aryl furan fluorescence UNIV NORTH CAROLINA CHAPEL HILL (US) 1997-06-04 CN disclosed
WO-1996040997-A1 METHOD OF FLUORESCENT DETECTION OF NUCLEIC ACIDS AND CYTOSKELETON ELEMENTS USING BIS-DICATIONIC ARYL FURANS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1996-12-19 WO disclosed
EP-0098629-B1 ANTI-COAGULANTS OF THE 4-HYDROXYCOUMARIN TYPE, THE PREPARATION THEREOF, AND RODENTICIDAL COMPOSITIONS (BAITS) COMPRISING SUCH ANTI-COAGULANTS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1987-08-26 EP disclosed
US-4520007-A Anti-coagulants of the 4-hydroxycoumarin type and rodenticidal compositions (baits) comprising such anti-coagulants SHELL OIL COMPANY (US) 1985-05-28 US disclosed
EP-0098629-A1 Anti-coagulants of the 4-hydroxycoumarin type, the preparation thereof, and rodenticidal compositions (baits) comprising such anti-coagulants SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1984-01-18 EP 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 (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-20220306654-A1 MECHANOREDOX REACTION USING PIEZOELECTRIC MATERIAL, AND PRODUCTION METHOD USING SAID REACTION PIEZO1, PPOX, TAOK1 TAAR1 3370/4885TSHR 4009/4885MAPT 4647/4885
US-11634400-B2 Micheliolide derivatives, methods for their preparation and their use as anticancer and antiinflammatory agents TNF, C9, CYP51A1 TAAR1 4609/4885TSHR 4837/4885MAPT 4273/4885
US-20200277270-A1 MICHELIOLIDE DERIVATIVES, METHODS FOR THEIR PREPARATION AND THEIR USE AS ANTICANCER AND ANTIINFLAMMATORY AGENTS TNF, C9, CYP51A1 TAAR1 4609/4885TSHR 4837/4885MAPT 4273/4885
US-20160115508-A1 PARTHENOLIDE DERIVATIVES, METHODS FOR THEIR PREPARATION AND THEIR USE AS ANTICANCER AGENTS CYP3A43, POR, CYP3A4 TAAR1 4846/4885TSHR 4561/4885MAPT 4289/4885

“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.