SCHEMBL25921941

SCHEMBL25921941

CC(=O)Oc1ccc(CSc2nc(=O)ccn2CC(N)=O)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PLA2G7 Q13093 4/20 0.42
▸ PTGDR2 Q9Y5Y4 1/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ DAO P14920 1/20 0.35
▸ MAPT P10636 3/20 0.33
▸ POLB P06746 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33

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
SCHEMBL25921419 0.90 PTGDR2 (0.44) PLA2G7PTGDR2SMN1; SMN2ALDH1A1TSHR
SCHEMBL25921524 0.85 PLA2G7 (0.39) PLA2G7PTGDR2SMN1; SMN2ALDH1A1TSHR
SCHEMBL25921417 0.83 PLA2G7 (0.41) PLA2G7SMN1; SMN2TSHRKMT2AMEN1
SCHEMBL25921708 0.79 PLA2G7 (0.36) PLA2G7PTGDR2SMN1; SMN2DAOKMT2A
SCHEMBL25921491 0.69 LMNA (0.41) SMN1; SMN2ALDH1A1TSHRDAOMAPT
SCHEMBL26068381 0.67 PTGDR2 (0.46) PTGDR2SMN1; SMN2ALDH1A1MAPTPOLB
SCHEMBL14611612 0.66 LMNA (0.52) SMN1; SMN2ALDH1A1TSHRMAPTPOLB
SCHEMBL6031811 0.66 LMNA (0.55) SMN1; SMN2ALDH1A1MAPTPOLBKMT2A
SCHEMBL10568442 0.64 LMNA (0.59) MAPTPOLB
SCHEMBL14139588 0.64 LMNA (0.53) SMN1; SMN2ALDH1A1TSHRMAPTPOLB

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-2023140040-A1 AMIDITE MONOMER 国立大学法人東海国立大学機構 2023-07-27 — — WO disclosed
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