SCHEMBL7384303

SCHEMBL7384303

CCOC(=O)CC1C(=O)NCCN1OC(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.56
KMT2A Q03164 3/20 0.52
ALDH1A1 P00352 5/20 0.50
MAPT P10636 2/20 0.50
CYP3A4 P08684 2/20 0.49
CYP2C19 P33261 2/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
HTT P42858 1/20 0.48
MEN1 O00255 1/20 0.47
RAB9A P51151 1/20 0.47
ATM Q13315 1/20 0.47
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.46
TSHR P16473 1/20 0.45
L3MBTL1 Q9Y468 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
SCHEMBL7999890 0.89 L3MBTL1 (0.50) POLBKMT2AHTTLMNATSHR
SCHEMBL1343383 0.82 KMT2A (0.61) POLBKMT2AALDH1A1MAPTCYP3A4
SCHEMBL12569137 0.81 TSHR (0.68) POLBKMT2AALDH1A1MAPTCYP3A4
SCHEMBL5743015 0.77 KMT2A (0.56) POLBKMT2AALDH1A1MAPTCYP3A4
SCHEMBL9003051 0.75 KMT2A (0.68) POLBKMT2AALDH1A1MAPTCYP3A4
SCHEMBL5104062 0.75 POLB (0.63) POLBKMT2AALDH1A1MAPTCYP3A4
SCHEMBL9003054 0.75 KMT2A (0.68) POLBKMT2AALDH1A1MAPTCYP3A4
SCHEMBL5104059 0.74 POLB (0.62) POLBKMT2AALDH1A1MAPTCYP3A4
SCHEMBL27783476 0.70 POLB (0.42) POLBKMT2AALDH1A1MAPTCYP3A4
SCHEMBL6626488 0.70 POLB (0.57) POLBKMT2AALDH1A1MAPTCYP3A4

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
EP-0641779-A1 Novel 1-amidinopiperdines and 4-amidinomorpholines as aggregation inhibitions F. HOFFMANN-LA ROCHE AG (CH) 1995-03-08 EP disclosed