SCHEMBL538930

SCHEMBL538930

FC(F)(F)c1cccc([Mg]Br)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
MAPK1 P28482 1/20 0.48
CES2 O00748 1/20 0.44
MGLL Q99685 1/20 0.44
ALDH1A1 P00352 2/20 0.42
TAAR1 Q96RJ0 1/20 0.41
IDO1 P14902 2/20 0.40
HTR3E A5X5Y0 1/20 0.40
HTR3B O95264 1/20 0.40
HTR3A P46098 1/20 0.40
HTR3D Q70Z44 1/20 0.40
HTR3C Q8WXA8 1/20 0.40
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NFE2L2 Q16236 1/20 0.38

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
SCHEMBL11624973 0.83 TSHR (0.39) TSHRMAPK1ALDH1A1IDO1MAPT
SCHEMBL20184786 0.78 TSHR (0.48) TSHRMAPK1CES2MGLLALDH1A1
SCHEMBL664647 0.78 HDAC8 (0.42) ALDH1A1GAAMAPTTDP1
Bromide SCHEMBL20184810 0.78 TSHR (0.48) TSHRMAPK1CES2MGLLALDH1A1
Hydrochloric Acid SCHEMBL20184802 0.78 TSHR (0.48) TSHRMAPK1CES2MGLLALDH1A1
Iodide SCHEMBL20184829 0.78 TSHR (0.48) TSHRMAPK1CES2MGLLALDH1A1
SCHEMBL40035 0.78 TSHR (0.48) TSHRMAPK1CES2MGLLALDH1A1
Bromide SCHEMBL6049119 0.77 TSHR (0.47) TSHRMAPK1CES2MGLLALDH1A1
SCHEMBL432591 0.77 CES2 (0.41) TSHRMAPK1CES2ALDH1A1IDO1
SCHEMBL62723 0.75 TSHR (0.67) TSHRMAPK1CES2MGLLALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250066297-A1 COMPOUNDS USEFUL FOR THE PREPARATION OF VARIOUS AGROCHEMICALS AND MARKERS THEREOF ADAMA AGAN LTD. (IL) 2025-02-27 US claimed
EP-4447681-A2 COMPOUNDS USEFUL FOR THE PREPARATION OF VARIOUS AGROCHEMICALS AND MARKERS THEREOF Adama Agan Ltd. (IL) 2024-10-23 EP claimed
CN-118401112-A Compounds for preparing various agrochemicals and markers thereof 安道麦阿甘有限公司 2024-07-26 CN claimed
WO-2023112033-A2 COMPOUNDS USEFUL FOR THE PREPARATION OF VARIOUS AGROCHEMICALS AND MARKERS THEREOF ADAMA AGAN LTD. (IL) 2023-06-22 WO claimed
US-8759586-B2 Processes for the preparation of cinacalcet RANBAXY LABORATORIES LIMITED (IN) 2014-06-24 US claimed
US-20120309842-A1 PROCESSES FOR THE PREPARATION OF CINACALCET RANBAXY LABORATORIES LIMITED (IN) 2012-12-06 US claimed
EP-2477959-A1 PROCESSES FOR THE PREPARATION OF CINACALCET Ranbaxy Laboratories Limited (IN) 2012-07-25 EP claimed
WO-2011033473-A1 PROCESSES FOR THE PREPARATION OF CINACALCET RANBAXY LABORATORIES LIMITED (IN) 2011-03-24 WO claimed
EP-0025880-A1 Azetidine derivative, its production, the derivative for use as an anti-obesity agent Takeda Chemical Industries, Ltd. (JP) 1981-04-01 EP claimed
US-20260022095-A1 COMPOUNDS USEFUL FOR THE PREPARATION OF VARIOUS AGROCHEMICALS AND MARKERS THEREOF ADAMA AGAN LTD. (IL) 2026-01-22 US disclosed
US-20250197350-A1 COMPOUNDS USEFUL FOR THE PREPARATION OF VARIOUS AGROCHEMICALS AND MARKERS THEREOF ADAMA AGAN LTD. (IL) 2025-06-19 US disclosed
US-20250066297-A1 COMPOUNDS USEFUL FOR THE PREPARATION OF VARIOUS AGROCHEMICALS AND MARKERS THEREOF ADAMA AGAN LTD. (IL) 2025-02-27 US disclosed
EP-4508980-A2 COMPOUNDS USEFUL FOR THE PREPARATION OF VARIOUS AGROCHEMICALS AND MARKERS THEREOF Adama Agan Ltd. (IL) 2025-02-19 EP disclosed
CN-119447480-A Electrolyte and preparation method and application thereof 蜂巢能源科技股份有限公司 2025-02-14 CN disclosed
US-4146539-A MOOD MODIFYERS, ANTIDEPRESSANTS BEECHAM GROUP LIMITED (GB) 1979-03-27 US disclosed
US-4144047-A SOYBEANS MONSANTO COMPANY (US) 1979-03-13 US disclosed
US-4140780-A ANTIOBESITY AGENTS SCHERING CORPORATION (US) 1979-02-20 US disclosed
US-4080335-A Anorexic chromans BEECHAM GROUP LIMITED (GB) 1978-03-21 US disclosed
US-4052383-A ANTIOBESITY SCHERING CORPORATION (US) 1977-10-04 US disclosed
US-3963701-A DIURETIC, ANTICOAGULANT RICHARDSON-MERRELL INC. (US) 1976-06-15 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 (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-20120309842-A1 PROCESSES FOR THE PREPARATION OF CINACALCET CA4, SI, CA9 TSHR 4377/4885MAPK1 3279/4885CES2 630/4885
US-20260022095-A1 COMPOUNDS USEFUL FOR THE PREPARATION OF VARIOUS AGROCHEMICALS AND MARKERS THEREOF TET1, FOXK1, TET3 TSHR 4148/4885MAPK1 3487/4885CES2 3313/4885
US-20250197350-A1 COMPOUNDS USEFUL FOR THE PREPARATION OF VARIOUS AGROCHEMICALS AND MARKERS THEREOF GYS2, PFAS, CD68 TSHR 4691/4885MAPK1 4201/4885CES2 646/4885
US-20250066297-A1 COMPOUNDS USEFUL FOR THE PREPARATION OF VARIOUS AGROCHEMICALS AND MARKERS THEREOF GYS2, PFAS, CD68 TSHR 4691/4885MAPK1 4201/4885CES2 646/4885

“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.