SCHEMBL6984283

SCHEMBL6984283

Cc1c(OC(=O)CN)cccc1C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.38
GRM6 O15303 1/20 0.36
EPHX2 P34913 1/20 0.36
AR P10275 1/20 0.35
ELANE P08246 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
GAA P10253 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
UTS2R Q9UKP6 1/20 0.34
TMPRSS15 P98073 1/20 0.34
KDM4E B2RXH2 1/20 0.34
RECQL P46063 1/20 0.34
POLB P06746 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34

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
SCHEMBL6723581 0.87 ELANE (0.44) SLC7A5ELANEMEN1KMT2AALDH1A1
SCHEMBL6981261 0.85 SLC7A5 (0.37) SLC7A5EPHX2ARELANEMEN1
SCHEMBL6582605 0.85 SLC7A5 (0.37) SLC7A5EPHX2ARELANEMEN1
SCHEMBL6985192 0.84 KMT2A (0.42) SLC7A5MEN1KMT2AALDH1A1GAA
SCHEMBL6988917 0.83 SLC7A5 (0.36) SLC7A5EPHX2ARELANEMEN1
SCHEMBL6985172 0.83 AR (0.36) SLC7A5EPHX2ARELANEMEN1
SCHEMBL6984974 0.80 SLC6A3 (0.40) SLC7A5EPHX2KMT2AALDH1A1KDM4E
SCHEMBL4962205 0.79 GRM6 (0.38) GRM6ARELANEMEN1KMT2A
SCHEMBL9103077 0.79 GRM6 (0.38) GRM6ARELANEMEN1KMT2A
SCHEMBL6984002 0.77 SMN1; SMN2 (0.40) SLC7A5MEN1KMT2AALDH1A1GAA

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-1289972-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2003-03-12 EP disclosed
WO-2001096323-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2001-12-20 WO disclosed