SCHEMBL31395451

SCHEMBL31395451

CC(=O)N(C)C1CCOc2ccc(Br)cc21

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ADRA2A P08913 2/20 0.41
▸ MAPT P10636 2/20 0.38
▸ HTT P42858 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HCRTR2 O43614 1/20 0.37
▸ PIK3CG P48736 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ RAB9A P51151 4/20 0.34
▸ NPC1 O15118 3/20 0.34
▸ MAOB P27338 1/20 0.34
▸ TERT O14746 2/20 0.34
▸ KDM4C Q9H3R0 1/20 0.34
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ KDM4E B2RXH2 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
SCHEMBL30816242 0.83 ADRA2A (0.47) ADRA2AMAPTHTTNPSR1ALDH1A1
SCHEMBL27204277 0.83 ADRA2A (0.47) ADRA2AMAPTHTTNPSR1ALDH1A1
SCHEMBL27159912 0.83 ADRA2A (0.47) ADRA2AMAPTHTTNPSR1ALDH1A1
SCHEMBL12269707 0.80 GAA (0.41) HTTALDH1A1RAB9AKDM4E
SCHEMBL19658610 0.77 ADRA2A (0.42) ADRA2AKDM4C
SCHEMBL27817330 0.74 ADRA2A (0.47) ADRA2AMAPTHTTNPSR1ALDH1A1
SCHEMBL1843412 0.73 ADRA2A (0.46) ADRA2AMAPTHTTHCRTR2LMNA
SCHEMBL25202695 0.71 ADRA2A (0.50) ADRA2AMAPTHTTHCRTR2LMNA
SCHEMBL1271967 0.71 MAP3K14 (0.51) ADRA2AMAPTHTTHCRTR2LMNA
SCHEMBL28768358 0.71 ADRA2A (0.42) ADRA2AMAPTHTTALDH1A1HCRTR2

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-4739307-A2 TARGETED EPIGENETIC THERAPIES FOR DISORDERS OF PROGRANULIN DEFICIENCY The General Hospital Corporation (US) 2026-05-13 — — EP disclosed
WO-2025010291-A2 TARGETED EPIGENETIC THERAPIES FOR DISORDERS OF PROGRANULIN DEFICIENCY THE GENERAL HOSPITAL CORPORATION (US) 2025-01-09 — — WO disclosed
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