SCHEMBL29333320

SCHEMBL29333320

CC(=O)OCc1ncc(Br)cc1OC(F)F

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.41
RXRA P19793 3/20 0.34
GRIN1 Q05586 3/20 0.34
GRIN2B Q13224 3/20 0.34
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 2/20 0.32
PDE4A P27815 4/20 0.31
PTGER1 P34995 2/20 0.31
PDE4B Q07343 2/20 0.31
PDE4C Q08493 2/20 0.31
PDE4D Q08499 2/20 0.31
GAA P10253 1/20 0.31
CA2 P00918 1/20 0.31

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
SCHEMBL2067188 0.83 NPC1 (0.37) NPC1RAB9AMAPTKMT2AALDH1A1
SCHEMBL31691297 0.79 ALDH1A1 (0.35) L3MBTL1ALDH1A1CA2
SCHEMBL5734033 0.77 AGBL2 (0.37) LMNAPOLBKMT2AALDH1A1CA2
SCHEMBL2067833 0.76 NOTUM (0.37) L3MBTL1POLBKMT2AALDH1A1CA2
SCHEMBL30994666 0.75 SSTR4 (0.39) KMT2AALDH1A1CA2
SCHEMBL29333332 0.75 SSTR4 (0.39) KMT2AALDH1A1CA2
SCHEMBL27028670 0.72 L3MBTL1 (0.44) L3MBTL1LMNAPOLBMAPTKMT2A
SCHEMBL29829389 0.72 L3MBTL1 (0.44) L3MBTL1LMNAPOLBMAPTKMT2A
SCHEMBL21591039 0.71 L3MBTL1 (0.38) L3MBTL1RXRAGRIN1GRIN2BNPC1
SCHEMBL21591101 0.70 L3MBTL1 (0.38) L3MBTL1NPC1RAB9ALMNAPOLB

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-4648851-A1 SUBSTITUTED (HETERO)ANILINES AND THEIR USE Astrazeneca AB (SE) 2025-11-19 EP disclosed
WO-2024149728-A1 SUBSTITUTED (HETERO)ANILINES AND THEIR USE ASTRAZENECA AB (SE) 2024-07-18 WO disclosed
WO-2024149728-A1 SUBSTITUTED (HETERO)ANILINES AND THEIR USE ASTRAZENECA AB (SE) 2024-07-18 WO disclosed