SCHEMBL9162832

SCHEMBL9162832

COC(=O)S/C(=C\N(C)C)C(=O)c1ccccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
CYP11B1 P15538 5/20 0.40
CYP11B2 P19099 2/20 0.40
MAOB P27338 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
PPIA P62937 1/20 0.35
TAS2R14 Q9NYV8 1/20 0.34
CTSS P25774 1/20 0.34
KCNK3 O14649 1/20 0.34
KCNK9 Q9NPC2 1/20 0.34
RBP4 P02753 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
SCHEMBL9162839 1.00 LMNA (0.41) LMNAGAACYP11B1CYP11B2MAOB
SCHEMBL9166573 0.83 LMNA (0.43) LMNAGAACYP11B1CYP11B2MAOB
SCHEMBL2307646 0.73 LMNA (0.44) LMNAGAACYP11B1CYP11B2SMN1; SMN2
SCHEMBL2307648 0.73 LMNA (0.44) LMNAGAACYP11B1CYP11B2SMN1; SMN2
SCHEMBL9874152 0.72 LMNA (0.43) LMNAGAACYP11B1CYP11B2SMN1; SMN2
SCHEMBL9874146 0.72 LMNA (0.43) LMNAGAACYP11B1CYP11B2SMN1; SMN2
SCHEMBL402157 0.71 MEN1 (0.44) LMNAGAACYP11B1CYP11B2KCNK3
SCHEMBL402156 0.71 MEN1 (0.44) LMNAGAACYP11B1CYP11B2KCNK3
SCHEMBL8745973 0.70 LMNA (0.41) LMNAGAACYP11B1CYP11B2SMN1; SMN2
SCHEMBL28634751 0.69 LMNA (0.64) LMNAGAASMN1; SMN2PPIAKCNK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-0425247-A2 5-Substituted-2,4-diphenylpyrimidine derivatives, their production and herbicidal use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-05-02 EP disclosed