SCHEMBL6167072

SCHEMBL6167072

CC(C)(C)OC(=O)NC1(CC2CC(=O)N(Cc3ccccc3)C2)CC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
TSHR P16473 2/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 3/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
LMNA P02545 2/20 0.42
HTT P42858 1/20 0.42
NPFFR1 Q9GZQ6 1/20 0.42
NPFFR2 Q9Y5X5 1/20 0.42
HPGD P15428 1/20 0.42
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
NPC1 O15118 1/20 0.41
GLA P06280 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL6164665 0.81 NPFFR1 (0.48) KMT2AL3MBTL1NPFFR1NPFFR2
SCHEMBL4671695 0.79 KMT2A (0.45) ALDH1A1TSHRMAPK1KMT2AL3MBTL1
SCHEMBL9142209 0.78 SIGMAR1 (0.46) ALDH1A1TSHRMAPK1KMT2AL3MBTL1
SCHEMBL5233534 0.77 ALDH1A1 (0.44) ALDH1A1TSHRMAPK1KMT2AL3MBTL1
SCHEMBL6865331 0.77 KMT2A (0.60) ALDH1A1TSHRMAPK1KMT2AL3MBTL1
SCHEMBL5425216 0.77 KMT2A (0.60) ALDH1A1TSHRMAPK1KMT2AL3MBTL1
SCHEMBL5232248 0.76 ALDH1A1 (0.43) ALDH1A1TSHRMAPK1KMT2AL3MBTL1
SCHEMBL5238965 0.76 ALDH1A1 (0.43) ALDH1A1TSHRMAPK1KMT2AL3MBTL1
SCHEMBL4713895 0.76 KMT2A (0.47) MAPK1KMT2AL3MBTL1LMNAHPGD
SCHEMBL4713900 0.76 KMT2A (0.47) MAPK1KMT2AL3MBTL1LMNAHPGD

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-1134219-B1 CYCLOALKYL-SUBSTITUTED AMINOMETHYLPYRROLIDINE DERIVATIVES DAIICHI SEIYAKU CO (JP) 2005-06-15 EP disclosed
US-6573260-B1 Antibiotics DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-06-03 US disclosed
EP-1134219-A1 CYCLOALKYL-SUBSTITUTED AMINOMETHYLPYRROLIDINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-09-19 EP disclosed