SCHEMBL8310642

SCHEMBL8310642

CSc1ccc(C(=O)CC(=O)C2CC2)c2c1SCCO2

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.33
HPGD P15428 1/20 0.31
MTNR1A P48039 3/20 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
SCHEMBL8308747 0.91 HSD17B10 (0.33) HSD17B10HPGDMTNR1A
SCHEMBL8310183 0.82 CTNNB1 (0.33) MTNR1A
SCHEMBL8307988 0.82 HPGD (0.31) HPGDMTNR1A
SCHEMBL8309840 0.80 MTNR1A (0.32) HSD17B10MTNR1A
SCHEMBL8310338 0.79 MEN1 (0.34) HSD17B10MTNR1A
SCHEMBL8307188 0.78 CTNNB1 (0.33) MTNR1A
SCHEMBL8310386 0.77 KDM4E (0.43) HSD17B10
SCHEMBL6184733 0.75 HSD17B10 (0.33) HSD17B10HPGD
SCHEMBL8310035 0.75
SCHEMBL8307724 0.71 MEN1 (0.34) HSD17B10HPGDMTNR1A

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
EP-0918056-A1 Herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1999-05-26 EP disclosed