SCHEMBL24512480

SCHEMBL24512480

Cc1ccc(-c2nnc(-c3ccccc3)[nH]2)cc1SN1CC(O)C1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
NPY5R Q15761 1/20 0.31
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL24512337 0.91 NPY5R (0.35) POLBL3MBTL1NPY5R
SCHEMBL24512285 0.88 NPY5R (0.38) POLBL3MBTL1NPY5RGAAMAPT
SCHEMBL24512323 0.81 CNR1 (0.40) POLBL3MBTL1NPC1RAB9ANPY5R
SCHEMBL24512352 0.79 ITGB2 (0.38) POLBL3MBTL1NPY5R
SCHEMBL24512299 0.77 ALDH1A1 (0.39) POLBL3MBTL1NPC1RAB9AGAA
SCHEMBL24512287 0.75 ALDH1A1 (0.36) POLBL3MBTL1NPC1RAB9AGAA
SCHEMBL30899268 0.74 CNR1 (0.43) POLBL3MBTL1GAAMAPT
SCHEMBL24512244 0.74 CNR1 (0.43) POLBL3MBTL1GAAMAPT
SCHEMBL24512300 0.73 PIK3C3 (0.37)
SCHEMBL24512341 0.73 LMNA (0.33) POLBL3MBTL1NPC1RAB9AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022125989-A1 COMPOUNDS AND USE THEREOF FOR TREATMENT OF NEURODEGENERATIVE, DEGENERATIVE AND METABOLIC DISORDERS SCRIPPS RESEARCH INSTITUTE, THE (US) 2022-06-16 WO disclosed