SCHEMBL31261864

SCHEMBL31261864

COc1nccc2c(S(=O)(=O)N3CCN(C(C)(C)C)CC3)csc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ GAA P10253 2/20 0.34
▸ USP2 O75604 2/20 0.34
▸ PKM P14618 3/20 0.33
▸ L3MBTL1 Q9Y468 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ ABCB1 P08183 1/20 0.33
▸ ABCC1 P33527 1/20 0.33
▸ ABCG2 Q9UNQ0 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ GBA1 P04062 1/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ PKLR P30613 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ PIK3CD O00329 1/20 0.32

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
SCHEMBL31261846 0.83 TGM2 (0.44) ALDH1A1SMN1; SMN2TSHR
SCHEMBL31261862 0.69 POLB (0.49) —
SCHEMBL31399731 0.67 MAPT (0.45) ALDH1A1ALOX15KMT2AGAAUSP2
SCHEMBL24469343 0.66 GRM5 (0.36) ALDH1A1GAA
SCHEMBL31261850 0.65 GPR119 (0.50) —
SCHEMBL10131910 0.64 PKM (0.78) ALDH1A1ALOX15KMT2AGAAUSP2
SCHEMBL31399766 0.64 ROCK2 (0.63) ALDH1A1KMT2ASMN1; SMN2KDM4ENPC1
SCHEMBL31399710 0.63 ALDH1A1 (0.49) ALDH1A1GAASMN1; SMN2KDM4ELMNA
SCHEMBL7049151 0.61 ROCK2 (0.71) ALDH1A1KMT2ASMN1; SMN2KDM4ERAB9A
SCHEMBL21688438 0.60 ROCK2 (0.66) KMT2ASMN1; SMN2KDM4E

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-4739671-A1 NEW COMPOUNDS Aston University (GB) 2026-05-13 — — EP disclosed
WO-2025008627-A1 NEW COMPOUNDS ASTON UNIVERSITY (GB) 2025-01-09 — — WO disclosed
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