SCHEMBL31083140

SCHEMBL31083140

COc1cc(-c2sc(C)nc2F)ccc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.37
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
EGFR P00533 2/20 0.35
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35
APH1A Q96BI3 1/20 0.35
PSENEN Q9NZ42 1/20 0.35
LPL P06858 2/20 0.33
LIPG Q9Y5X9 2/20 0.33
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
TTK P33981 1/20 0.32
AHR P35869 1/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
GAA P10253 1/20 0.31
RECQL P46063 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
SCHEMBL26941397 0.76 LPL (0.55) EGFRLPLLIPG
SCHEMBL31083366 0.75 DYRK1A (0.43) PTGS1PTGS2PSEN1PSEN2APH1B
SCHEMBL24920099 0.74 KDM4E (0.43) SNCALMNAMAPTGAA
SCHEMBL2658964 0.72 LPL (0.45) EGFRLPLLIPG
SCHEMBL29458129 0.72 HTT (0.46) MAPT
SCHEMBL25384525 0.72 HTT (0.46) MAPT
SCHEMBL26050415 0.71 EGFR (0.43) SNCAEGFRLPLLIPGLMNA
SCHEMBL28644942 0.71 ALDH1A1 (0.62) LMNAMAPTGAA
SCHEMBL15334799 0.71 ACHE (0.47) EGFRLPLLIPGLMNAMAPT
SCHEMBL24165203 0.70 ALOX15 (0.51) SNCAEGFRLMNAMAPTGAA

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-2024182747-A2 COMPOUNDS AND METHODS FOR MODULATING SPLICING REMIX THERAPEUTICS INC. (US) 2024-09-06 WO disclosed