SCHEMBL613603

SCHEMBL613603

Br[Mg]Cc1cccc(Br)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.52
IDO1 P14902 2/20 0.50
AGXT P21549 2/20 0.50
MAOB P27338 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
PYCR1 P32322 1/20 0.41
CYP11B1 P15538 1/20 0.41
ADRA2C P18825 1/20 0.41
CYP11B2 P19099 1/20 0.41
MBTD1 Q05BQ5 1/20 0.40
L3MBTL3 Q96JM7 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL31736930 0.80 TAAR1 (0.55) TAAR1IDO1AGXTMAOBSMN1; SMN2
SCHEMBL11152261 0.78 TAAR1 (0.59) TAAR1IDO1AGXTMAOBSMN1; SMN2
SCHEMBL933385 0.76 TAAR1 (0.50) TAAR1IDO1MAOBCYP11B1CYP11B2
SCHEMBL1538033 0.76 TAAR1 (0.50) TAAR1IDO1AGXTMAOBSMN1; SMN2
SCHEMBL1001014 0.76 PNMT (0.54) TAAR1IDO1AGXTMAOB
SCHEMBL9200966 0.75 TAAR1 (0.60) TAAR1IDO1AGXTMAOBSMN1; SMN2
SCHEMBL4399626 0.75 TAAR1 (0.74) TAAR1IDO1AGXTMAOBSMN1; SMN2
SCHEMBL11149029 0.75 TAAR1 (0.55) TAAR1IDO1AGXTMAOBSMN1; SMN2
SCHEMBL29353789 0.73
SCHEMBL6882 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025242747-A1 MULTI -COMPONENT FORMULATIONS OF ORGANOMETALLIC REAGENTS MERCK PATENT GMBH (DE) 2025-11-27 WO claimed
US-7273948-B2 Process of preparing esters and ethers of probucol and derivatives thereof ATHEROGENICS, INC. (US) 2007-09-25 US claimed
EP-1594824-A4 PROCESS OF PREPARING ESTERS AND ETHERS OF PROBUCOL AND DERIVATIVES THEREOF ATHEROGENICS INC (US) 2007-04-04 EP claimed
EP-1594824-A2 PROCESS OF PREPARING ESTERS AND ETHERS OF PROBUCOL AND DERIVATIVES THEREOF Atherogenics, Inc. (US) 2005-11-16 EP claimed
US-20040204485-A1 Process of preparing esters and ethers of probucol and derivatives thereof CRABTREE ACQUISITION CO, LLC 2004-10-14 US claimed
WO-2004062622-A2 PROCESS OF PREPARING ESTERS AND ETHERS OF PROBUCOL AND DERIVATIVES THEREOF ATHEROGENICS, INC. (US) 2004-07-29 WO claimed
US-20260132149-A1 Bridged Cyclic 5-Amino-6,8-Dihydro-1H-Furo[3,4-D]Pyrrolo[3,2-B]Pyridine-2-Carboxamide Compounds, Compositions Thereof, and Methods of Treatment Therewith BEONE MEDICINES I GMBH (CH) 2026-05-14 US disclosed
WO-2025242747-A1 MULTI -COMPONENT FORMULATIONS OF ORGANOMETALLIC REAGENTS MERCK PATENT GMBH (DE) 2025-11-27 WO disclosed
US-12049461-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections GILEAD SCIENCES, INC. (US) 2024-07-30 US disclosed
EP-3704113-B1 BRIDGED BICYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS BRISTOL MYERS SQUIBB CO (US) 2023-10-11 EP disclosed
US-11634449-B2 Macrolides and methods of their preparation and use PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-04-25 US disclosed
EP-4095146-A1 MACROLIDES AND METHODS OF THEIR PREPARATION AND USE President And Fellows Of Harvard College (US) 2022-11-30 EP disclosed
US-20220332747-A1 MACROLIDES AND METHODS OF THEIR PREPARATION AND USE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2022-10-20 US disclosed
US-20020065308-A1 EP4 receptor selective agonists in the treatment of osteoporosis LOTUS PHARMACEUTICAL CO., LTD. (JP) 2002-05-30 US disclosed
WO-2002042268-A2 EP4 RECEPTOR SELECTIVE AGONISTS IN THE TREATMENT OF OSTEOPOROSIS PFIZER PRODUCTS INC. (US) 2002-05-30 WO disclosed
US-20020040149-A1 EP4 receptor selective agonists in the treatment of osteoporosis CAMERON KIMBERLY O'KEEFE (US) 2002-04-04 US disclosed
WO-2002016393-A1 17-ARYL-LINKER DERIVATISED ESTROGEN 3-SULPHAMATES AS INHIBITORS OF STEROID SULPHATASE STERIX LIMITED (GB) 2002-02-28 WO disclosed
US-20010047105-A1 EP4 receptor selective agonists in the treatment of osteoporosis PFIZER PRODUCTS INC. 2001-11-29 US disclosed
WO-2001046140-A1 EP4 RECEPTOR SELECTIVE AGONISTS IN THE TREATMENT OF OSTEOPOROSIS PFIZER PRODUCTS INC. (US) 2001-06-28 WO disclosed
EP-1110949-A1 EP4 receptor selective agonists in the treatment of osteoporosis Pfizer Products Inc. (US) 2001-06-27 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 (8 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-12049461-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections NR3C1, NR3C2, NR4A1 TAAR1 319/4885IDO1 1289/4885AGXT 3804/4885
US-20220332747-A1 MACROLIDES AND METHODS OF THEIR PREPARATION AND USE CYP11B2, ERG28, DHCR7 TAAR1 4465/4885IDO1 3560/4885AGXT 1251/4885
US-20020040149-A1 EP4 receptor selective agonists in the treatment of osteoporosis PTGER4, PTGER1, PTGER2 TAAR1 1909/4885IDO1 417/4885AGXT 4349/4885
US-11634449-B2 Macrolides and methods of their preparation and use CYP11B2, ERG28, DHCR7 TAAR1 4465/4885IDO1 3560/4885AGXT 1251/4885
US-20260132149-A1 Bridged Cyclic 5-Amino-6,8-Dihydro-1H-Furo[3,4-D]Pyrrolo[3,2-B]Pyridine-2-Carboxamide Compounds, Compositions Thereof, and Methods of Treatment Therewith MECP2, PRMT5, DNMT1 TAAR1 3730/4885IDO1 3024/4885AGXT 3877/4885
US-20020065308-A1 EP4 receptor selective agonists in the treatment of osteoporosis PTGER4, PTGER1, PTGER2 TAAR1 1736/4885IDO1 591/4885AGXT 4390/4885
US-20010047105-A1 EP4 receptor selective agonists in the treatment of osteoporosis PTGER4, PTGER1, PTGER2 TAAR1 1909/4885IDO1 417/4885AGXT 4349/4885
US-20040204485-A1 Process of preparing esters and ethers of probucol and derivatives thereof NR3C2, MGLL, GCG TAAR1 3193/4885IDO1 4697/4885AGXT 598/4885

“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.