SCHEMBL8908505

SCHEMBL8908505

COC(=O)CC1C2CCCC1CCC2

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.39
EPHX2 P34913 3/20 0.38
BRD4 O60885 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B10 Q99714 1/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL1066268 0.91 TSHR (0.42) TSHREPHX2BRD4MEN1KMT2A
SCHEMBL10519951 0.79 BRD4 (0.42) TSHREPHX2BRD4KMT2AHSD17B10
SCHEMBL3753078 0.79 MGAM (0.43) EPHX2KMT2AHSD17B10MGAMGAA
SCHEMBL14388470 0.78 TSHR (0.37) TSHREPHX2BRD4MEN1KMT2A
SCHEMBL3631878 0.77
SCHEMBL2747443 0.77 HSD11B1 (0.57) TSHREPHX2BRD4MEN1KMT2A
SCHEMBL10389690 0.75 CYP2D6 (0.40) TSHREPHX2BRD4MEN1KMT2A
SCHEMBL23567008 0.74 CHRNB2 (0.48) TSHRBRD4MEN1KMT2A
SCHEMBL13390625 0.74 MEN1 (0.41) TSHRBRD4MEN1KMT2A
SCHEMBL16229100 0.74 HSD11B1 (0.44) TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5658923-A USED IN TREATING DISEASES RELATED TO SIGMA-RECEPTOR, SUCH AS SCHIZOPHRENIA ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1997-08-19 US disclosed