SCHEMBL30957326

SCHEMBL30957326

COc1ccc(Br)cc1-c1ncccn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.56
▸ RAB9A P51151 2/20 0.56
▸ TSHR P16473 1/20 0.56
▸ POLB P06746 1/20 0.51
▸ HTT P42858 2/20 0.51
▸ MGAM O43451 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ SI P14410 1/20 0.49
▸ MGAM2 Q2M2H8 1/20 0.49
▸ ALPL P05186 1/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ MAPT P10636 3/20 0.44
▸ RXFP1 Q9HBX9 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ PPARG P37231 1/20 0.44
▸ GFER P55789 1/20 0.44
▸ NCOA2 Q15596 1/20 0.44
▸ NCOA1 Q15788 1/20 0.44

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
SCHEMBL27764861 0.86 ALPL (0.42) NPC1RAB9ATSHRHTTMGAM
SCHEMBL30957364 0.82 MAOB (0.46) NPC1RAB9ATSHRPOLBALDH1A1
SCHEMBL30957312 0.81 NPC1 (0.51) NPC1RAB9ATSHRPOLBHTT
SCHEMBL3907740 0.81 NPC1 (0.49) NPC1RAB9ATSHRPOLBHTT
SCHEMBL3917166 0.81 NPC1 (0.49) NPC1RAB9ATSHRPOLBHTT
SCHEMBL14125145 0.80 GAA (0.56) NPC1RAB9ATSHRPOLBHTT
SCHEMBL14951063 0.80 ACHE (0.50) NPC1RAB9ATSHRHTTGAA
SCHEMBL21981564 0.79 CYP19A1 (0.41) NPC1RAB9ATSHRGAAALDH1A1
SCHEMBL29685386 0.79 SYK (0.50) TSHRALDH1A1CYP19A1
SCHEMBL9566435 0.76 MGAM (0.54) NPC1RAB9ATSHRPOLBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4598933-A1 PHOSPHORAMIDATE COMPOUNDS AND USES THEREOF Allorion Therapeutics Inc (US) 2025-08-13 — — EP disclosed
CN-119968377-A Phosphoramidate compounds and uses thereof 安锐生物医药公司 2025-05-09 — — CN disclosed
WO-2024078392-A1 PHOSPHORAMIDATE COMPOUNDS AND USES THEREOF ANRUI BIOMEDICAL TECHNOLOGY (GUANGZHOU) CO., LTD. (CN) 2024-04-18 — — WO disclosed
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