SCHEMBL18192052

SCHEMBL18192052

CCOC(=O)C1(CCN)CCN(Cc2ccccc2)CC1

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.72
KMT2A Q03164 8/20 0.69
MEN1 O00255 7/20 0.69
POLB P06746 2/20 0.69
L3MBTL1 Q9Y468 2/20 0.67
OPRM1 P35372 3/20 0.66
OPRD1 P41143 3/20 0.66
P4HB P07237 1/20 0.65
ALDH1A1 P00352 4/20 0.64
KDM4E B2RXH2 2/20 0.64
PKM P14618 1/20 0.61
MAPK1 P28482 1/20 0.60
CYP3A4 P08684 1/20 0.60
CYP2D6 P10635 1/20 0.60
CYP2C9 P11712 1/20 0.60
CYP2C19 P33261 1/20 0.60

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
SCHEMBL20608072 0.89 LMNA (0.64) LMNAKMT2AMEN1POLBL3MBTL1
SCHEMBL609304 0.87 KDM4E (0.79) LMNAKMT2AMEN1POLBL3MBTL1
SCHEMBL4864670 0.86 L3MBTL1 (0.77) LMNAKMT2AMEN1POLBL3MBTL1
SCHEMBL26102667 0.86 LMNA (0.69) LMNAKMT2AMEN1POLBL3MBTL1
SCHEMBL3317836 0.85 LMNA (0.68) LMNAKMT2AMEN1POLBL3MBTL1
SCHEMBL31643319 0.84 KMT2A (0.67) LMNAKMT2AMEN1POLBL3MBTL1
SCHEMBL7012242 0.84 LMNA (0.67) LMNAKMT2AMEN1POLBL3MBTL1
SCHEMBL15353093 0.83 LMNA (0.65) LMNAKMT2AMEN1POLBL3MBTL1
SCHEMBL13118614 0.82 LMNA (0.65) LMNAKMT2AMEN1POLBL3MBTL1
SCHEMBL4609435 0.82 CYP3A4 (0.65) LMNAKMT2AMEN1POLBL3MBTL1

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-2877471-B1 SPIRO-FUSED PIPERIDINE DERIVATIVES FOR USE AS INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME (US) 2016-11-02 EP disclosed