SCHEMBL20159607

SCHEMBL20159607

CN1CCC(NC(=O)C2CCN(C)CC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.51
GAA P10253 2/20 0.51
TSHR P16473 1/20 0.51
EPHX2 P34913 5/20 0.49
MAPK1 P28482 2/20 0.49
ALDH1A1 P00352 5/20 0.49
LMNA P02545 2/20 0.49
POLB P06746 1/20 0.48
CYP2D6 P10635 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
CYP3A4 P08684 2/20 0.46
RAB9A P51151 2/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
NPC1 O15118 1/20 0.45

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
SCHEMBL13783322 0.96 MAPK1 (0.53) L3MBTL1GAATSHREPHX2MAPK1
SCHEMBL10265288 0.96 POLB (0.53) L3MBTL1GAATSHREPHX2MAPK1
SCHEMBL13746318 0.92 GAA (0.61) L3MBTL1GAATSHREPHX2MAPK1
SCHEMBL17625632 0.92 L3MBTL1 (0.57) L3MBTL1GAATSHREPHX2MAPK1
SCHEMBL13783325 0.92 L3MBTL1 (0.61) L3MBTL1GAATSHREPHX2MAPK1
SCHEMBL13745743 0.90 GAA (0.64) L3MBTL1GAATSHREPHX2MAPK1
SCHEMBL8257182 0.90 GAA (0.64) L3MBTL1GAATSHREPHX2MAPK1
SCHEMBL14472719 0.90 KDM5A (0.45) L3MBTL1GAATSHREPHX2MAPK1
SCHEMBL13783326 0.90 L3MBTL1 (0.64) L3MBTL1GAATSHREPHX2MAPK1
SCHEMBL23583243 0.89 MAPK1 (0.63) L3MBTL1GAATSHREPHX2MAPK1

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
WO-2018089695-A1 TOLL-LIKE RECEPTOR ANTAGONIST COMPOUNDS AND METHODS OF USE DYNAVAX TECHNOLOGIES CORPORATION (US) 2018-05-17 WO disclosed