SCHEMBL20140997

SCHEMBL20140997

C[C@H]1CN(c2ncccc2S(N)(=O)=O)CCN1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 7/20 0.47
TRPV1 Q8NER1 2/20 0.45
SMO Q99835 3/20 0.44
HSD11B1 P28845 3/20 0.43
AVPR1A P37288 1/20 0.41
RBP4 P02753 1/20 0.41
SLC6A7 Q99884 2/20 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
SCHEMBL20129733 0.86 GPR119 (0.50) GRM1TRPV1HSD11B1RBP4
SCHEMBL4262115 0.81 TRPV1 (0.64) TRPV1HSD11B1
SCHEMBL4258832 0.81 TRPV1 (0.55) GRM1TRPV1SMOHSD11B1AVPR1A
SCHEMBL4258836 0.81 TRPV1 (0.55) GRM1TRPV1SMOHSD11B1AVPR1A
SCHEMBL20140927 0.79 CA1 (0.47) TRPV1HSD11B1
SCHEMBL4266990 0.78 TRPV1 (0.69) GRM1TRPV1HSD11B1RBP4
SCHEMBL20141349 0.77 SMO (0.45) GRM1SMOSLC6A7
SCHEMBL20129734 0.76 PRKCQ (0.45) TRPV1HSD11B1
SCHEMBL16236002 0.76 GRM1 (0.64) GRM1SMOSLC6A7
SCHEMBL20133726 0.74 CHIA (0.48) TRPV1HSD11B1

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