SCHEMBL28980321

SCHEMBL28980321

CC(=O)Nn1ccc2cc(Cl)ccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OXER1 Q8TDS5 1/20 0.43
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 2/20 0.37
KMO O15229 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
KRAS P01116 2/20 0.37
ROCK2 O75116 1/20 0.37
PIM1 P11309 1/20 0.37
PIM3 Q86V86 1/20 0.37
DYRK1A Q13627 1/20 0.36
FSCN1 Q16658 1/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36

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
SCHEMBL4101401 0.87 OXER1 (0.46) OXER1HTR2AHTR2CRXFP1SLC6A2
SCHEMBL27777662 0.84 OXER1 (0.43) OXER1HTR2AHTR2CRXFP1SLC6A2
SCHEMBL28980350 0.82 FABP4 (0.41) HTR2AHTR2CRXFP1KDM4EHSD17B10
SCHEMBL28980330 0.81 MCL1 (0.43) HTR2AHTR2CSLC6A2KDM4EHSD17B10
SCHEMBL8836401 0.80 OXER1 (0.44) OXER1HTR2AHTR2CRXFP1SLC6A2
SCHEMBL28980358 0.78 MTNR1A (0.50) HTR2CKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL28980348 0.77 KIF11 (0.41) RXFP1ALDH1A1KRASDYRK1AKMT2A
SCHEMBL28980345 0.77 DYRK1A (0.40) KDM4EHSD17B10ALDH1A1HPGDDYRK1A
SCHEMBL4103818 0.77 KMT2A (0.50) OXER1RXFP1ALDH1A1KMT2ACA12
SCHEMBL10973432 0.76 NOTUM (0.55) SLC6A2KDM4EHSD17B10ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115894326-B 2, 3-Hydrogen substituted aminoindole derivative, preparation method and application thereof 佛山大学 2025-02-11 CN disclosed
CN-115894326-A 2,3-hydrogen substituted aminoindole derivative, preparation method and application thereof 佛山科学技术学院 2023-04-04 CN disclosed