SCHEMBL16401548

SCHEMBL16401548

CC(OC(=O)NC1CCCCC1)c1cn(-c2ccccc2)nn1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
RAB9A P51151 1/20 0.44
GRM5 P41594 1/20 0.44
FAAH O00519 2/20 0.42
GLA P06280 1/20 0.42
TSHR P16473 1/20 0.41
EPHX1 P07099 2/20 0.41
LMNA P02545 2/20 0.41
ACKR3 P25106 1/20 0.41
SLC6A9 P48067 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL16401690 0.76 MEN1 (0.59) ALDH1A1GLAEPHX1
SCHEMBL16401797 0.75 EPHX1 (0.47) ALDH1A1RAB9AGLAEPHX1SLC6A9
SCHEMBL14223546 0.68 ALDH1A1 (0.47) ALDH1A1RAB9AGRM5FAAHTSHR
SCHEMBL9634370 0.67 NOTUM (0.50) GLA
SCHEMBL16401891 0.67 CA9 (0.50) RAB9ASMN1; SMN2
SCHEMBL13119830 0.67 P2RX7 (0.50) ALDH1A1GLAGAA
SCHEMBL14223545 0.66 ALDH1A1 (0.45) ALDH1A1RAB9AGRM5FAAHTSHR
SCHEMBL31286268 0.66 NAAA (0.47) ALDH1A1RAB9AFAAHTSHREPHX1
SCHEMBL2201239 0.66 ALDH1A1 (0.51) ALDH1A1RAB9ALMNASMN1; SMN2GAA
SCHEMBL17509955 0.66 NAAA (0.47) ALDH1A1RAB9AFAAHTSHREPHX1

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
WO-2015007613-A1 O-ALKYL TRIAZOLYL CARBAMATES AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE (FAAH) FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2015-01-22 WO claimed
WO-2015007613-A1 O-ALKYL TRIAZOLYL CARBAMATES AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE (FAAH) FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2015-01-22 WO disclosed