SCHEMBL29948146

SCHEMBL29948146

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
SCHEMBL9948439 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120025355-A Condensed ring compound, organic electroluminescent device and electronic equipment 海宁奕诺炜特科技有限公司 2025-05-23 CN disclosed
CN-114981265-B Compounds of formula (I) CTXT私人有限公司 2025-01-03 CN disclosed
CN-117355517-A Macrocyclic glucagon-like peptide 1 receptor agonists 伊莱利利公司 2024-01-05 CN disclosed
CN-116056543-A Light-emitting element 三星显示有限公司 2023-05-02 CN disclosed
WO-2022266711-A1 SUBSTITUTED AMIDOBENZIMIDAZOLE DIMERS AS STING MODULATORS Aculeus Therapeutics Pty Ltd (AU) 2022-12-29 WO disclosed
EP-4077318-A1 COMPOUNDS CTXT PTY LTD (AU) 2022-10-26 EP disclosed
CN-114981265-A Compound (I) CTXT私人有限公司 2022-08-30 CN disclosed