SCHEMBL24453074

SCHEMBL24453074

O=C(COc1ccc(C2CO2)cc1)OC(CS(=O)(=O)O)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 2/20 0.35
PSEN2 P49810 2/20 0.35
APH1B Q8WW43 2/20 0.35
NCSTN Q92542 2/20 0.35
APH1A Q96BI3 2/20 0.35
PSENEN Q9NZ42 2/20 0.35
GAA P10253 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
POLB P06746 1/20 0.32
GLA P06280 1/20 0.32
ALDH1A1 P00352 5/20 0.31
MAPT P10636 2/20 0.31
LMNA P02545 2/20 0.31
PKM P14618 1/20 0.31
MEN1 O00255 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
AOC2 O75106 3/20 0.30
MAOA P21397 2/20 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
SCHEMBL24452961 0.84 MGLL (0.36)
SCHEMBL24452785 0.81 LMNA (0.31) NPSR1MAPTLMNASMN1; SMN2
SCHEMBL20403882 0.80 ALOX15 (0.44) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL21786247 0.79 MAPT (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL24453075 0.78 MGLL (0.30)
SCHEMBL24292293 0.78 SMN1; SMN2 (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL19846661 0.77 THRB (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL24452960 0.76 PARP1 (0.38) POLBALDH1A1
SCHEMBL24452958 0.76 ALDH1A1 (0.45) GAAALDH1A1MAPTLMNAPKM
SCHEMBL24452784 0.76 BCHE (0.33)

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-4006921-A2 BIO-ELECTRODE COMPOSITION, BIO-ELECTRODE, METHOD FOR MANUFACTURING BIO-ELECTRODE, AND REACTION COMPOSITE Shin-Etsu Chemical Co., Ltd. (JP) 2022-06-01 EP disclosed
US-20220160281-A1 BIO-ELECTRODE COMPOSITION, BIO-ELECTRODE, METHOD FOR MANUFACTURING BIO-ELECTRODE, AND REACTION COMPOSITE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-05-26 US disclosed