SCHEMBL29520150

SCHEMBL29520150

Cc1cc(-c2cnc(S(C)(=O)=O)nc2C2CC2)on1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 17/20 0.52
SIGMAR1 Q99720 8/20 0.52
KCNH2 Q12809 5/20 0.48
PIK3CD O00329 2/20 0.39
PIK3CB P42338 2/20 0.39
PIK3CG P48736 2/20 0.39
PRKAB2 O43741 1/20 0.39
PRKAG1 P54619 1/20 0.39
PRKAA2 P54646 1/20 0.39
PRKAA1 Q13131 1/20 0.39
PRKAG3 Q9UGI9 1/20 0.39
PRKAG2 Q9UGJ0 1/20 0.39
PRKAB1 Q9Y478 1/20 0.39
MTOR P42345 1/20 0.39

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
SCHEMBL26185427 1.00 TMEM97 (0.52) TMEM97SIGMAR1KCNH2PIK3CDPIK3CB
SCHEMBL30534004 0.77 TMEM97 (0.51) TMEM97SIGMAR1KCNH2PRKAB2PRKAG1
SCHEMBL29519886 0.77 PIK3CD (0.39) TMEM97SIGMAR1KCNH2PIK3CDPIK3CB
SCHEMBL26185436 0.77 PIK3CD (0.39) TMEM97SIGMAR1KCNH2PIK3CDPIK3CB
SCHEMBL26185481 0.77 TMEM97 (0.51) TMEM97SIGMAR1KCNH2PRKAB2PRKAG1
SCHEMBL24349021 0.75 PRKAB2 (0.64) TMEM97SIGMAR1KCNH2PRKAB2PRKAG1
SCHEMBL24349024 0.74 TMEM97 (0.48) TMEM97SIGMAR1KCNH2PRKAB2PRKAG1
SCHEMBL24348337 0.73 TMEM97 (0.53) TMEM97SIGMAR1KCNH2PRKAB2PRKAG1
SCHEMBL24348482 0.73 PRKAB2 (0.65) TMEM97SIGMAR1KCNH2PRKAB2PRKAG1
SCHEMBL24349022 0.73 PRKAB2 (0.62) TMEM97SIGMAR1KCNH2PRKAB2PRKAG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116457354-A Herbicidal pyrimidine derivatives 摩雅科技有限公司 2023-07-18 CN disclosed
EP-4204416-A1 HERBICIDAL PYRIMIDINE DERIVATIVES Moa Technology Limited (GB) 2023-07-05 EP disclosed
WO-2022053803-A1 HERBICIDAL PYRIMIDINE DERIVATIVES MOA Technology Limited (GB) 2022-03-17 WO disclosed