SCHEMBL20159138

SCHEMBL20159138

CC(C)(C)OC(=O)N1CCN(c2cc(F)ccc2C#N)CC1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.48
FFAR4 Q5NUL3 1/20 0.47
MAPT P10636 2/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
NR1H2 P55055 1/20 0.47
NR1H3 Q13133 1/20 0.47
RET P07949 7/20 0.46
EGLN2 Q96KS0 1/20 0.44

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
SCHEMBL2459991 0.91 GPR119 (0.50) GPR119MAPTALDH1A1LMNANR1H2
SCHEMBL16935349 0.85 BACE1 (0.49) GPR119MAPTALDH1A1LMNANR1H2
SCHEMBL3922803 0.84 GPR119 (0.48) GPR119MAPTALDH1A1LMNANR1H2
SCHEMBL20139774 0.83 NR1H2 (0.48) GPR119FFAR4MAPTALDH1A1LMNA
SCHEMBL652792 0.83 GRM5 (0.53) GPR119MAPTALDH1A1LMNA
SCHEMBL24984504 0.82 GPR119 (0.45) GPR119MAPTALDH1A1LMNANR1H2
SCHEMBL30163884 0.82 GPR119 (0.45) GPR119MAPTALDH1A1LMNANR1H2
SCHEMBL15114426 0.82 MAPT (0.49) MAPTALDH1A1LMNA
SCHEMBL6269762 0.82 GPR119 (0.57) GPR119MAPTALDH1A1LMNANR1H2
SCHEMBL31474292 0.82 GPR119 (0.57) GPR119MAPTALDH1A1LMNANR1H2

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-2018089493-A1 PYRROLE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed