SCHEMBL9711539

SCHEMBL9711539

CC1(C)CC(=O)C(C(=O)c2ccc(S(C)(=O)=O)cc2Cl)C(=O)N1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
MAPT P10636 3/20 0.38
GAA P10253 1/20 0.38
RAB9A P51151 1/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP2C19 P33261 1/20 0.36
PPARG P37231 1/20 0.36
NCOA2 Q15596 1/20 0.36
NCOA1 Q15788 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
USP28 Q96RU2 7/20 0.36
AVPR2 P30518 1/20 0.36
GPR27 Q9NS67 1/20 0.36
GPR6 P46095 1/20 0.36
SMO Q99835 1/20 0.35

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
SCHEMBL9135303 0.84 LMNA (0.43) LMNAMAPTGAARAB9AMEN1
SCHEMBL9711542 0.84 HPD (0.41) LMNAMAPTGAARAB9AMEN1
SCHEMBL9711670 0.80 HTT (0.31)
SCHEMBL9711451 0.80 LMNA (0.42) LMNAMAPTGAARAB9AMEN1
SCHEMBL9711513 0.78 SLC6A4 (0.31)
Sulcotrione SCHEMBL16899684 0.78 LMNA (0.47) LMNAMAPTGAARAB9AMEN1
Sulcotrione SCHEMBL29565861 0.78 LMNA (0.47) LMNAMAPTGAARAB9AMEN1
Sulcotrione SCHEMBL55030 0.78 LMNA (0.47) LMNAMAPTGAARAB9AMEN1
SCHEMBL9134592 0.77 LMNA (0.41) LMNAMAPTGAARAB9AMEN1
SCHEMBL9134108 0.76 LMNA (0.44) LMNAMAPTGAARAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5114461-A Herbicides MAY & BAKER LIMITED (GB) 1992-05-19 US disclosed
EP-0354047-A2 Herbicidal method using atrazine MAY & BAKER LIMITED (GB) 1990-02-07 EP disclosed
EP-0354046-A2 Herbicidal method using bromoxynil MAY & BAKER LIMITED (GB) 1990-02-07 EP disclosed
EP-0278742-A2 Cyclic diones MAY & BAKER LIMITED (GB) 1988-08-17 EP disclosed