SCHEMBL11244247

SCHEMBL11244247

COc1cc(OC)cc(C(=O)NC2CCCCC2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 1.00
KMT2A Q03164 1/20 1.00
LMNA P02545 2/20 0.76
ALDH1A1 P00352 3/20 0.63
L3MBTL1 Q9Y468 2/20 0.59
ATM Q13315 1/20 0.59
POLB P06746 2/20 0.59
F2 P00734 1/20 0.58
PLG P00747 1/20 0.58
PRSS1 P07477 1/20 0.58
PRSS2 P07478 1/20 0.58
PRSS3 P35030 1/20 0.58
ST14 Q9Y5Y6 1/20 0.58
HPGDS O60760 2/20 0.57
MCHR1 Q99705 1/20 0.57
RAB9A P51151 6/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
HPGD P15428 3/20 0.57
NPC1 O15118 4/20 0.56
GAA P10253 2/20 0.56

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
SCHEMBL2470064 0.92 MEN1 (0.84) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL26400144 0.86 MEN1 (0.75) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL11241115 0.85 RAB9A (0.75) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL11240479 0.84 RAB9A (0.76) MEN1KMT2ALMNAALDH1A1RAB9A
SCHEMBL1667825 0.83 RAB9A (0.73) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL3213423 0.83 MEN1 (0.70) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL5652949 0.83 MEN1 (0.70) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL5652947 0.83 MEN1 (0.70) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL29890124 0.83 MEN1 (0.70) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL3140700 0.83 POLB (0.77) MEN1KMT2AALDH1A1L3MBTL1POLB

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-4342875-A STABILIZERS FOR OLEFIN POLYMERS CINCINNATI-MILACRON, INC. (US) 1982-08-03 US disclosed