SCHEMBL20141180

SCHEMBL20141180

Cc1cc(F)c(N(c2ccccc2C#N)C2CCNCC2)cc1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 11/20 0.41
SLC6A4 P31645 10/20 0.41
NOTUM Q6P988 1/20 0.37
NOS2 P35228 3/20 0.35
SLC6A3 Q01959 5/20 0.35
NOS3 P29474 2/20 0.34
NOS1 P29475 2/20 0.34
KIF11 P52732 1/20 0.34
KCNH2 Q12809 1/20 0.34
P2RY12 Q9H244 1/20 0.33

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
SCHEMBL20141353 0.92 SLC6A2 (0.39) SLC6A2SLC6A4NOTUMNOS2SLC6A3
SCHEMBL20140898 0.91 SLC6A4 (0.41) SLC6A2SLC6A4NOTUMNOS2SLC6A3
SCHEMBL20141181 0.91 SLC6A4 (0.41) SLC6A2SLC6A4NOTUMNOS2SLC6A3
SCHEMBL20141030 0.89 SLC6A2 (0.38) SLC6A2SLC6A4NOS2SLC6A3NOS3
SCHEMBL20141216 0.85 SLC6A2 (0.38) SLC6A2SLC6A4NOS2SLC6A3NOS3
SCHEMBL20141214 0.85 SLC6A2 (0.38) SLC6A2SLC6A4NOS2SLC6A3NOS3
SCHEMBL20140936 0.84 SLC6A2 (0.41) SLC6A2SLC6A4NOTUMNOS2SLC6A3
SCHEMBL20140933 0.83 SLC6A2 (0.36) SLC6A2SLC6A4NOS2SLC6A3NOS3
SCHEMBL20141405 0.82 NOTUM (0.38) SLC6A2SLC6A4NOTUMNOS2SLC6A3
SCHEMBL20141385 0.81 NOS2 (0.42) SLC6A2SLC6A4NOS2SLC6A3NOS3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3538091-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF Navitor Pharmaceuticals, Inc. (US) 2019-09-18 EP disclosed
WO-2018089499-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed