SCHEMBL31586722

SCHEMBL31586722

CCOC(CNS(=O)(=O)c1ccc(Br)c(C)c1)OCC

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.47
▸ HTT P42858 1/20 0.42
▸ GAA P10253 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ KMT2A Q03164 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ MAPT P10636 1/20 0.38
▸ GBA1 P04062 1/20 0.38
▸ CCR2 P41597 1/20 0.38

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
SCHEMBL31586373 0.87 HTT (0.46) ALDH1A1HTTGAAKMT2AMAPK1
SCHEMBL7257565 0.81 GAA (0.58) ALDH1A1GAAKMT2AMEN1GBA1
SCHEMBL30569570 0.80 GBA1 (0.59) ALDH1A1HTTGAAPOLBKMT2A
SCHEMBL16492321 0.79 ALDH1A1 (0.65) ALDH1A1HTTKMT2ACCR2
SCHEMBL850431 0.77 BRAF (0.43) ALDH1A1GAAPOLBKMT2AMEN1
SCHEMBL850432 0.77 BRAF (0.43) ALDH1A1GAAPOLBKMT2AMEN1
SCHEMBL13065421 0.76 ALDH1A1 (0.55) ALDH1A1HTTGAAPOLBMAPT
SCHEMBL27771985 0.75 GBA1 (0.53) ALDH1A1KMT2AMEN1TSHRMAPK1
SCHEMBL848030 0.73 ALDH1A1 (0.58) ALDH1A1HTTGAAMAPK1
SCHEMBL2371658 0.73 CCR2 (0.46) ALDH1A1KMT2AMEN1TSHRMAPK1

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-2025103502-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN INC. (US) 2025-05-22 — — WO disclosed
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