SCHEMBL29628969

SCHEMBL29628969

Clc1cccc(Oc2ccccc2Br)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.54
SLC6A2 P23975 2/20 0.54
SLC6A3 Q01959 2/20 0.54
RHEB Q15382 4/20 0.51
LMNA P02545 1/20 0.50
HTR1A P08908 1/20 0.50
HTR2A P28223 1/20 0.46
KCNH2 Q12809 1/20 0.46
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP3A4 P08684 1/20 0.43
KMT2A Q03164 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
ALOX12 P18054 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL11817660 1.00 SLC6A4 (0.54) SLC6A4SLC6A2SLC6A3RHEBLMNA
SCHEMBL3839158 0.86 ALDH1A1 (0.44) SLC6A4SLC6A2SLC6A3LMNAKMT2A
SCHEMBL30542929 0.85 RHEB (0.54) SLC6A4SLC6A2SLC6A3RHEBLMNA
SCHEMBL16890362 0.85 RHEB (0.54) SLC6A4SLC6A2SLC6A3RHEBLMNA
SCHEMBL31448395 0.84 RHEB (0.48) SLC6A4SLC6A2SLC6A3RHEBLMNA
SCHEMBL23406389 0.84 SLC6A4 (0.53) SLC6A4SLC6A2SLC6A3RHEBLMNA
SCHEMBL30542928 0.84 SLC6A4 (0.53) SLC6A4SLC6A2SLC6A3RHEBLMNA
SCHEMBL31323130 0.83 RHEB (0.49) SLC6A4SLC6A2SLC6A3RHEBLMNA
SCHEMBL3841096 0.81 ALDH1A1 (0.50) KMT2AL3MBTL1MEN1ALDH1A1MAPT
SCHEMBL11814145 0.81 SLC6A4 (0.57) SLC6A4SLC6A2SLC6A3RHEBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114605433-B Indenothiophene dioxide structure-containing organic material and application thereof 北京燕化集联光电技术有限公司 2024-02-27 CN disclosed
CN-114773360-B Organic material and application thereof in electroluminescent device 北京燕化集联光电技术有限公司 2024-01-05 CN disclosed
CN-114560870-B Sulfur-containing polycyclic aromatic compound and application thereof 北京燕化集联光电技术有限公司 2024-01-05 CN disclosed
CN-114573601-B Indenothiene dioxide structure-containing compound and application thereof 北京燕化集联光电技术有限公司 2024-01-05 CN disclosed
CN-114773360-A Organic material and application thereof in electroluminescent device 北京燕化集联光电技术有限公司 2022-07-22 CN disclosed
CN-114656481-A Organic material and application thereof 北京燕化集联光电技术有限公司 2022-06-24 CN disclosed
CN-114621250-A Organic luminescent material and application thereof 北京燕化集联光电技术有限公司 2022-06-14 CN disclosed
CN-114605434-A Organic compound and application thereof 北京燕化集联光电技术有限公司 2022-06-10 CN disclosed
CN-114605433-A Organic material containing indenothiophene dioxide structure and application thereof 北京燕化集联光电技术有限公司 2022-06-10 CN disclosed
CN-114591350-A Compound containing spiro heterocyclic carbazole structure and application thereof 北京燕化集联光电技术有限公司 2022-06-07 CN disclosed
CN-114573601-A Compound containing indenothiophene dioxide structure and application thereof 北京燕化集联光电技术有限公司 2022-06-03 CN disclosed
CN-114560870-A Sulfur-containing polycyclic aromatic compound and application thereof 北京燕化集联光电技术有限公司 2022-05-31 CN disclosed