SCHEMBL9302685

SCHEMBL9302685

CCN(CC)C(=O)Oc1ccc(OC(=O)N(CC)CC)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 1.00
KMT2A Q03164 1/20 1.00
HSD17B10 Q99714 2/20 0.71
SMN1; SMN2 Q16637 1/20 0.71
LMNA P02545 4/20 0.64
L3MBTL1 Q9Y468 2/20 0.64
MAOA P21397 4/20 0.58
RAB9A P51151 1/20 0.58
SRD5A1 P18405 1/20 0.56
MAOB P27338 2/20 0.50
TSHR P16473 1/20 0.49
BCHE P06276 1/20 0.48
ACHE P22303 1/20 0.48

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
SCHEMBL5623889 0.94 MEN1 (0.88) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL8945322 0.92 KMT2A (0.85) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL19439086 0.90 MEN1 (0.81) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL8945706 0.90 MEN1 (0.81) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL2531879 0.90 MEN1 (0.81) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL10013782 0.90 MEN1 (0.81) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL12928357 0.90 MEN1 (0.81) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL5623546 0.90 MEN1 (0.81) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL1495914 0.89 MEN1 (0.79) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL18952877 0.88 LMNA (0.81) MEN1KMT2AHSD17B10SMN1; SMN2LMNA

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
US-5318993-A Antihyperlipidemic benzoquinones BRISTOL-MYERS SQUIBB COMPANY (US) 1994-06-07 US disclosed