SCHEMBL9836735

SCHEMBL9836735

COC(=O)CC1CC=CC1O

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.33
BRD4 O60885 1/20 0.33
EGFR P00533 1/20 0.33
HSD17B10 Q99714 2/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
MIF P14174 5/20 0.31
HDAC6 Q9UBN7 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL14535851 1.00 TSHR (0.33) TSHRBRD4EGFRHSD17B10CYP3A4
SCHEMBL16512555 0.82 TSHR (0.40) TSHRBRD4EGFRHSD17B10MAPT
SCHEMBL16512742 0.82 TSHR (0.40) TSHRBRD4EGFRHSD17B10MAPT
SCHEMBL4267252 0.80 MAPT (0.33) BRD4EGFRMAPT
SCHEMBL11279446 0.76 SLC6A12 (0.41)
SCHEMBL11547816 0.74 TSHR (0.33) TSHRBRD4HSD17B10MGAMGAA
SCHEMBL11547818 0.74 TSHR (0.33) TSHRBRD4HSD17B10MGAMGAA
SCHEMBL14499820 0.71 TSHR (0.46) TSHRBRD4EGFRHSD17B10CYP3A4
SCHEMBL5638546 0.71 TSHR (0.46) TSHRBRD4EGFRHSD17B10CYP3A4
SCHEMBL5638542 0.71 TSHR (0.46) TSHRBRD4EGFRHSD17B10CYP3A4

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
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
US-4818272-A NONPHYTOTOXICITY FOR CROPS HELICAL STREAMS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-04-04 US disclosed
EP-0241559-A1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1987-10-21 EP disclosed