SCHEMBL11490346

SCHEMBL11490346

COC(=O)C1(O)CC(C)(C)NC(C)(C)C1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GAA P10253 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PKM P14618 1/20 0.30
HTT P42858 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
SCHEMBL27509536 0.78 MEN1 (0.34) MEN1KMT2ALMNANPSR1GAA
SCHEMBL11056858 0.78 POLB (0.46) MEN1KMT2ALMNANPSR1GAA
SCHEMBL1311126 0.77 MEN1 (0.33) MEN1KMT2ALMNANPSR1GAA
SCHEMBL27529822 0.75 MEN1 (0.33) MEN1KMT2ALMNANPSR1
SCHEMBL11638963 0.75 KMT2A (0.33) MEN1KMT2ALMNANPSR1GAA
SCHEMBL2254068 0.75 FFAR3 (0.36) GAA
SCHEMBL1603102 0.75
SCHEMBL13509071 0.74 THRB (0.31)
SCHEMBL11642830 0.74 ALDH1A1 (0.41) MEN1KMT2ALMNAGAAL3MBTL1
SCHEMBL11641940 0.74 MAPT (0.33) MEN1KMT2ALMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4223147-A POLYMER STABILIZERS BAYER AKTIENGESELLSCHAFT (DE) 1980-09-16 US disclosed
US-4178279-A FIBERS AND FOILS BAYER AKTIENGESELLSCHAFT (DE) 1979-12-11 US disclosed
US-4153596-A PHOTOSTABILITY BAYER AKTIENGESELLSCHAFT (DE) 1979-05-08 US disclosed
US-4145512-A Permanently stabilized polyurethanes BAYER AKTIENGESELLSCHAFT (DE) 1979-03-20 US disclosed