SCHEMBL9166573

SCHEMBL9166573

CSC(=CN(C)C)C(=O)c1ccccc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
CYP11B1 P15538 4/20 0.41
CYP11B2 P19099 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
CTNNB1 P35222 1/20 0.37
WNT3A P56704 1/20 0.37
CNR2 P34972 1/20 0.36
POLQ O75417 1/20 0.36
MAOB P27338 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
NFKB1 P19838 1/20 0.36

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
SCHEMBL9162839 0.83 LMNA (0.41) LMNAGAACYP11B1CYP11B2SMN1; SMN2
SCHEMBL9162832 0.83 LMNA (0.41) LMNAGAACYP11B1CYP11B2SMN1; SMN2
SCHEMBL9874152 0.80 LMNA (0.43) LMNAGAACYP11B1CYP11B2SMN1; SMN2
SCHEMBL9874146 0.80 LMNA (0.43) LMNAGAACYP11B1CYP11B2SMN1; SMN2
SCHEMBL2307648 0.78 LMNA (0.44) LMNAGAACYP11B1CYP11B2SMN1; SMN2
SCHEMBL2307646 0.78 LMNA (0.44) LMNAGAACYP11B1CYP11B2SMN1; SMN2
SCHEMBL8745973 0.78 LMNA (0.41) LMNAGAACYP11B1CYP11B2SMN1; SMN2
SCHEMBL28634751 0.74 LMNA (0.64) LMNAGAASMN1; SMN2CTNNB1WNT3A
SCHEMBL9818400 0.73 RAB9A (0.46) LMNAGAASMN1; SMN2
SCHEMBL402157 0.73 MEN1 (0.44) LMNAGAACYP11B1CYP11B2POLQ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3141251-A None JP disclosed
US-5403948-A Treatment of 1-alkoxycarbonylthio-1-(trihaloalkylbenzoyl)-2-(n,n-dimethylamino)ethene with methyl iodide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-04-04 US disclosed
US-5349108-A Chemical intermediates for nonphytotoxic herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-09-20 US disclosed
US-5270467-A 5-substituted-2,4-diphenylpyrimidine derivatives SUMITOMO CHEMICAL CO., LTD. (JP) 1993-12-14 US disclosed
US-5190575-A 5-Methoxy- or -ethoxy, herbicides SUMITOMO CHEMICAL CO., LTD. (JP) 1993-03-02 US disclosed
JP-H03141251-A 1-METHYLMERCAPTO-1-BENZOYL-2-(N,N-DIMETHYLAMINO)ETHENE DERIVATIVE AND PRODUCTION THEREOF SUMITOMO CHEM CO LTD 1991-06-17 JP disclosed
EP-0425247-A2 5-Substituted-2,4-diphenylpyrimidine derivatives, their production and herbicidal use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-05-02 EP disclosed