SCHEMBL29786265

SCHEMBL29786265

CN(C)Cc1cccc(Br)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.47
HTR1A P08908 1/20 0.47
DRD2 P14416 1/20 0.47
HTR2A P28223 1/20 0.47
KDM1A O60341 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
MBOAT4 Q96T53 1/20 0.36
PARP1 P09874 1/20 0.35
IRAK4 Q9NWZ3 1/20 0.35
CHRNB2 P17787 1/20 0.34
CHRNA4 P43681 1/20 0.34
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34

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
SCHEMBL5846680 1.00 HTR7 (0.47) HTR7HTR1ADRD2HTR2AKDM1A
SCHEMBL522953 0.84 ALDH1A1 (0.44) ALDH1A1TSHRIRAK4CHRNB2CHRNA4
SCHEMBL5846763 0.83 HTR7 (0.49) HTR7HTR1ADRD2HTR2AKDM1A
SCHEMBL19130698 0.81 HTR7 (0.42) HTR7HTR1ADRD2HTR2AKDM1A
SCHEMBL12088921 0.81 HTR2A (0.39) HTR7HTR1ADRD2HTR2AKDM1A
SCHEMBL7498162 0.80 HTR7 (0.41) HTR7HTR1ADRD2HTR2AKDM1A
SCHEMBL3669973 0.78 HPGD (0.40) HTR7HTR1ADRD2HTR2AKDM1A
SCHEMBL2071403 0.77 GRIN2D (0.44) HTR7HTR1ADRD2HTR2AKDM1A
SCHEMBL6984577 0.77 IRAK4 (0.47) KDM1AMAOAMAOBALDH1A1TSHR
SCHEMBL10272748 0.77 GRIN2D (0.42) ALDH1A1TSHRPARP1IRAK4CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119874700-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2025-04-25 CN disclosed
CN-114945366-B HPK1 antagonists and uses thereof 林伯士萨顿公司 2025-01-07 CN disclosed
CN-114945366-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2022-08-26 CN disclosed
EP-4031531-A1 SUBSTITUTED IMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS Bial-R&D Investments, S.A. (PT) 2022-07-27 EP disclosed
CN-114787135-A Substituted imidazole carboxamides and their use in the treatment of medical disorders 比亚尔R&D投资股份公司 2022-07-22 CN disclosed