SCHEMBL30949552

SCHEMBL30949552

CC(C)(C)NC(=O)c1c(Br)ccc2[nH]ccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHPS P49366 3/20 0.39
AHR P35869 1/20 0.38
JAK2 O60674 1/20 0.35
HTR3E A5X5Y0 1/20 0.35
HTR3B O95264 1/20 0.35
HTR3A P46098 1/20 0.35
HTR3D Q70Z44 1/20 0.35
HTR3C Q8WXA8 1/20 0.35
IMPDH2 P12268 1/20 0.34
P2RX7 Q99572 5/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
PARP1 P09874 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
ANO1 Q5XXA6 1/20 0.33

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
SCHEMBL13987128 0.77 NR4A2 (0.47) AHRHTR3EHTR3BHTR3AHTR3D
SCHEMBL30949600 0.76 AHR (0.46) AHRHTR3EHTR3BHTR3AHTR3D
SCHEMBL23701819 0.73 DHPS (0.63) DHPSIMPDH2MEN1NPC1KMT2A
SCHEMBL30949503 0.72 CNR2 (0.44) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL30949614 0.72 EGLN1 (0.34) DHPSJAK2ANO1
SCHEMBL30949609 0.72 ALPL (0.34) DHPSJAK2HTR3EHTR3BHTR3A
SCHEMBL8995172 0.68 AHR (0.52) AHRP2RX7PARP1
SCHEMBL30949604 0.68 RAB9A (0.36) MEN1NPC1RAB9AKMT2A
SCHEMBL30949502 0.68 POLB (0.41) MEN1NPC1RAB9AKMT2A
SCHEMBL7753609 0.67 MAOA (0.53) IMPDH2NPC1RAB9AHDAC1HDAC6

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
EP-4652154-A1 NOVEL ALPK1 INHIBITORS Pyrotech (Beijing) Biotechnology Co., Ltd. (CN) 2025-11-26 EP disclosed
WO-2024153225-A1 NOVEL ALPK1 INHIBITORS PYROTECH (BEIJING) BIOTECHNOLOGY CO., LTD. (CN) 2024-07-25 WO disclosed