SCHEMBL4591981

SCHEMBL4591981

O=C1C[C@@H]2CC[C@H]1C1C(=O)N(c3cc(Br)cc(Br)c3)C(=O)[C@@H]12

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
ATM Q13315 1/20 0.40
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 6/20 0.34
ALDH1A1 P00352 4/20 0.34
HSD17B10 Q99714 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
POLB P06746 1/20 0.34
ALOX15 P16050 4/20 0.33
THRB P10828 1/20 0.33
MAPK1 P28482 1/20 0.30

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
SCHEMBL3194277 1.00 MEN1 (0.41) MEN1KMT2AL3MBTL1ATMLMNA
SCHEMBL3194285 1.00 MEN1 (0.41) MEN1KMT2AL3MBTL1ATMLMNA
SCHEMBL3194270 1.00 MEN1 (0.41) MEN1KMT2AL3MBTL1ATMLMNA
SCHEMBL3200111 0.85 MEN1 (0.49) MEN1KMT2AL3MBTL1ATMLMNA
SCHEMBL3200103 0.85 MEN1 (0.49) MEN1KMT2AL3MBTL1ATMLMNA
SCHEMBL3200093 0.85 MEN1 (0.49) MEN1KMT2AL3MBTL1ATMLMNA
SCHEMBL3189013 0.84 MEN1 (0.42) MEN1KMT2AL3MBTL1LMNASMN1; SMN2
SCHEMBL3189002 0.84 MEN1 (0.42) MEN1KMT2AL3MBTL1LMNASMN1; SMN2
SCHEMBL3189028 0.84 MEN1 (0.42) MEN1KMT2AL3MBTL1LMNASMN1; SMN2
SCHEMBL3197981 0.82 MEN1 (0.41) MEN1KMT2ALMNASMN1; SMN2TSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1379249-A4 FUSED CYCLIC SUCCINIMIDE COMPOUNDS AND ANALOGS THEREOF, MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION BRISTOL MYERS SQUIBB CO (US) 2008-01-09 EP claimed
EP-1379249-A1 FUSED CYCLIC SUCCINIMIDE COMPOUNDS AND ANALOGS THEREOF, MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION Bristol-Myers Squibb Company (US) 2004-01-14 EP claimed
WO-2002067939-A1 FUSED CYCLIC SUCCINIMIDE COMPOUNDS AND ANALOGS THEREOF, MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2002-09-06 WO claimed