SCHEMBL21596763

SCHEMBL21596763

CC(C)S(=O)(=O)N1CCC(OC(N)=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.46
ATM Q13315 1/20 0.39
NAMPT P43490 1/20 0.37
IKBKB O14920 1/20 0.36
CHUK O15111 1/20 0.36
FAAH O00519 1/20 0.36
HRH3 Q9Y5N1 2/20 0.34
CHRM2 P08172 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPY5R Q15761 1/20 0.34
CACNB4 O00305 2/20 0.34
CACNA1A O00555 2/20 0.34
CACNA1G O43497 2/20 0.34
CACNG3 O60359 2/20 0.34
CACNA1F O60840 2/20 0.34
CACNA1H O95180 2/20 0.34
CACNB3 P54284 2/20 0.34
CACNA2D1 P54289 2/20 0.34
CACNG7 P62955 2/20 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
SCHEMBL28734912 0.83 ATM (0.35) EPHX2ATMTP53
SCHEMBL28759274 0.81 TP53 (0.51) ATMTP53
SCHEMBL29077624 0.79 ATM (0.39) ATMMEN1KMT2ATP53
SCHEMBL4728819 0.77 EPHX2 (0.56) EPHX2TP53
SCHEMBL29191942 0.77 EPHX2 (0.41) EPHX2ATMNAMPTHRH3CACNB4
SCHEMBL28568099 0.77 EPHX2 (0.44) EPHX2NAMPTFAAHNPY5RCACNB4
SCHEMBL30884651 0.75 EPHX2 (0.61) EPHX2NPY5RCYP2C19
SCHEMBL21938016 0.75 TP53 (0.45) ATMTP53
SCHEMBL28011548 0.74 ATM (0.42) ATMCHRM2MEN1KMT2ATP53
SCHEMBL22991258 0.72 EPHX2 (0.50) EPHX2ATMIKBKBCHUKFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3810572-B1 POLYCYCLIC COMPOUNDS AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS UNIV BARCELONA (ES) 2023-11-15 EP disclosed
CN-112888674-B Polycyclic compounds as soluble epoxide hydrolase inhibitors 巴塞罗那大学 2023-06-30 CN disclosed
CN-114340634-A Heterocyclic compounds as kinase inhibitors 诺维逊生物股份有限公司 2022-04-12 CN disclosed
CN-112888674-A Polycyclic compounds as soluble epoxide hydrolase inhibitors 巴塞罗那大学 2021-06-01 CN disclosed
EP-3810572-A1 POLYCYCLIC COMPOUNDS AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS Universitat de Barcelona (ES) 2021-04-28 EP disclosed
WO-2019243414-A1 POLYCYCLIC COMPOUNDS AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS UNIVERSITAT DE BARCELONA (ES) 2019-12-26 WO disclosed