SCHEMBL9948439

SCHEMBL9948439

Fc1cc(Cl)cc(Br)c1Br

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.36
TSHR P16473 1/20 0.35
APEX1 P27695 1/20 0.35
ERN1 O75460 1/20 0.34
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KDM1A O60341 4/20 0.31
KDM1B Q8NB78 3/20 0.31
PDK2 Q15119 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
SCHEMBL29948146 1.00 AKR1B1 (0.36) AKR1B1TSHRAPEX1ERN1NPC1
SCHEMBL18073886 0.86 TSHR (0.41) AKR1B1TSHRNPC1RAB9AHPGD
SCHEMBL22342294 0.83 TSHR (0.39) AKR1B1TSHRNPC1RAB9AHPGD
SCHEMBL1349442 0.80 APEX1 (0.53) AKR1B1TSHRAPEX1ERN1PDK2
SCHEMBL28965365 0.79 ALDH1A1 (0.41) TSHRHPGDSMN1; SMN2KDM1AKDM1B
SCHEMBL29363756 0.79 PDK2 (0.37) TSHRERN1NPC1RAB9AHPGD
SCHEMBL29429741 0.79 TSHR (0.35) TSHRERN1NPC1RAB9AHPGD
SCHEMBL22165559 0.79 TSHR (0.35) TSHRERN1NPC1RAB9AHPGD
SCHEMBL263907 0.79 PDK2 (0.37) TSHRERN1NPC1RAB9AHPGD
SCHEMBL25205090 0.75 HSD17B10 (0.41) AKR1B1TSHRERN1HPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260132112-A1 COMPOUNDS CTXT PTY LTD (AU) 2026-05-14 US disclosed
US-12543500-B2 Light emitting element SAMSUNG DISPLAY CO., LTD. (KR) 2026-02-03 US disclosed
EP-4077318-B1 BENZIMIDAZOLE DIMERS AS MODULATORS OF STING CTXT PTY LTD (AU) 2025-10-15 EP disclosed
US-12415785-B2 Compound modulators of sting CTXT PTY LTD (AU) 2025-09-16 US disclosed
US-20240343740-A1 MACROCYCLIC GLUCAGON-LIKE PEPTIDE 1 RECEPTOR AGONISTS ELI LILLY AND COMPANY 2024-10-17 US disclosed
CN-114478603-B Organic boron condensed ring compound containing branch molecular structure and organic electroluminescent device 中国科学院长春应用化学研究所 2024-05-31 CN disclosed
EP-4341255-A1 MACROCYCLIC GLUCAGON-LIKE PEPTIDE 1 RECEPTOR AGONISTS Eli Lilly and Company (US) 2024-03-27 EP disclosed
CN-117355517-A Macrocyclic glucagon-like peptide 1 receptor agonists 伊莱利利公司 2024-01-05 CN disclosed
US-20230165131-A1 LIGHT EMITTING ELEMENT SAMSUNG DISPLAY CO., LTD. (KR) 2023-05-25 US disclosed
US-20230165131-A1 LIGHT EMITTING ELEMENT SAMSUNG DISPLAY CO., LTD. (KR) 2023-05-25 US disclosed
US-8592426-B2 Aryl-benzocycloalkyl amide derivatives Hoffmann—La Roche Inc. (US) 2013-11-26 US disclosed
EP-2658848-A1 NEW BIARYL AMIDE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2013-11-06 EP disclosed
CN-103328436-A Novel aryl-benzocycloalkylamide derivatives HOFFMANN LA ROCHE 2013-09-25 CN disclosed
US-20130018055-A1 NEW ARYL-BENZOCYCLOALKYL AMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2013-01-17 US disclosed
WO-2012101011-A2 NEW ARYL-BENZOCYCLOALKYL AMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-08-02 WO disclosed
WO-2012089601-A1 NEW BIARYL AMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-07-05 WO disclosed
US-20120165338-A1 NEW BIARYL AMIDE DERIVATIVES HOFFMANN-LA ROCHE INC. 2012-06-28 US disclosed
US-20110084230-A1 Process for Synthesizing Organoelemental Compounds LUDWIG-MAXIMILIANS-UNIVERSITAET MUENCHEN (DE) 2011-04-14 US disclosed
US-20110084230-A1 Process for Synthesizing Organoelemental Compounds LUDWIG-MAXIMILIANS-UNIVERSITAET MUENCHEN (DE) 2011-04-14 US disclosed
WO-2007113294-A1 PROCESS FOR SYNTHESIZING ORGANOELEMENTAL COMPOUNDS LUDWIG-MAXIMILIANS-UNIVERSITÄT MÜNCHEN (DE) 2007-10-11 WO 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 (7 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-20240343740-A1 MACROCYCLIC GLUCAGON-LIKE PEPTIDE 1 RECEPTOR AGONISTS GLP1R, GCGR, GIPR AKR1B1 1454/4885TSHR 99/4885APEX1 3877/4885
US-12543500-B2 Light emitting element CRY1, CRY2, CTNNA1 AKR1B1 2664/4885TSHR 1512/4885APEX1 318/4885
US-12415785-B2 Compound modulators of sting STING1, IRF3, MAVS AKR1B1 4283/4885TSHR 4301/4885APEX1 229/4885
US-20130018055-A1 NEW ARYL-BENZOCYCLOALKYL AMIDE DERIVATIVES CYP1A1, AHR, CYP1B1 AKR1B1 502/4885TSHR 445/4885APEX1 2356/4885
US-20260132112-A1 COMPOUNDS STING1, IRF3, CGAS AKR1B1 1921/4885TSHR 1389/4885APEX1 263/4885
US-20110084230-A1 Process for Synthesizing Organoelemental Compounds CHRM1, CHRM2, MLX AKR1B1 737/4885TSHR 290/4885APEX1 3820/4885
US-20120165338-A1 NEW BIARYL AMIDE DERIVATIVES BICRA, HDAC10, BRD7 AKR1B1 1040/4885TSHR 260/4885APEX1 2624/4885

“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.