SCHEMBL31328280

SCHEMBL31328280

CCOC(=O)C1CCN(C)C(Br)C1=O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
MAPT P10636 5/20 0.42
ALDH1A1 P00352 7/20 0.42
GAA P10253 2/20 0.41
HSD17B10 Q99714 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.39
TLR4 O00206 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL14593076 0.84 KMT2A (0.43) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL4080364 0.77 ALDH1A1 (0.51) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL5791081 0.77 ALDH1A1 (0.45) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL3913430 0.76 MEN1 (0.52) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL4077853 0.74 TLR4 (0.55) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL1617437 0.74 TLR4 (0.49) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL19349886 0.74 ALDH1A1 (0.48) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL12134814 0.73 ALDH1A1 (0.45) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL31328319 0.73 ALDH1A1 (0.42) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL19349842 0.73 ALDH1A1 (0.45) MEN1KMT2AMAPTALDH1A1GAA

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-4729510-A1 INDOLE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Suzhou Merna Therapeutics Co. Ltd (CN) 2026-04-22 EP disclosed
WO-2025007928-A1 INDOLE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 苏州湃芮生物科技有限公司 2025-01-09 WO disclosed