SCHEMBL31426435

SCHEMBL31426435

O=S(=O)(c1cccc(Br)c1)N1CC(F)(F)C1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MBTD1 Q05BQ5 1/20 0.52
L3MBTL3 Q96JM7 1/20 0.52
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
GPR183 P32249 1/20 0.45
SIRT2 Q8IXJ6 1/20 0.45
MMP2 P08253 2/20 0.44
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KIF18A Q8NI77 1/20 0.41
CYP3A4 P08684 1/20 0.40
GRM5 P41594 1/20 0.40
AKR1C3 P42330 2/20 0.40
LMNA P02545 2/20 0.40
TSHR P16473 2/20 0.40
THRB P10828 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HTT P42858 1/20 0.39

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
SCHEMBL26618202 1.00 MBTD1 (0.52) MBTD1L3MBTL3MEN1KMT2AGPR183
SCHEMBL3386199 0.84 MBTD1 (0.57) MBTD1L3MBTL3MEN1KMT2AGPR183
SCHEMBL17841225 0.81 PKM (0.58) ALDH1A1SMN1; SMN2KIF18ALMNATSHR
SCHEMBL15765139 0.80 MMP2 (0.49) GPR183MMP2ALDH1A1LMNATSHR
SCHEMBL18977620 0.79 CYP2C9 (0.55) MEN1KMT2AALDH1A1SMN1; SMN2CYP3A4
SCHEMBL3384758 0.78 MBTD1 (0.68) MBTD1L3MBTL3MEN1KMT2AGPR183
SCHEMBL28469863 0.78 MBTD1 (0.56) MBTD1L3MBTL3MEN1KMT2AGPR183
SCHEMBL263317 0.78 MBTD1 (0.73) MBTD1L3MBTL3MEN1KMT2ASIRT2
SCHEMBL31426410 0.77 CA12 (0.51) MEN1KMT2AALDH1A1SMN1; SMN2KIF18A
SCHEMBL20791554 0.77 MAPT (0.67) MEN1KMT2AALDH1A1SMN1; SMN2AKR1C3

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
CN-119451951-A Compounds for inhibition of KIF18A 沃拉斯查疗法公司 2025-02-14 CN disclosed