SCHEMBL13986499

SCHEMBL13986499

CC[C@H](C)[C@@H]1CCOC1O

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.34
KDM4E B2RXH2 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL13986497 1.00 SHBG (0.34) SHBGKDM4ETSHRHSD17B10
SCHEMBL15195996 0.79 SHBG (0.34) SHBG
SCHEMBL21007408 0.78
SCHEMBL22547011 0.78
SCHEMBL21007409 0.78
SCHEMBL23961124 0.77
SCHEMBL8166503 0.77
SCHEMBL8173406 0.77
SCHEMBL14213043 0.77
SCHEMBL11671529 0.70

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-7468448-B2 Production method of hexahydrofurofuranol derivative, intermediate therefor and production method thereof SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2008-12-23 US disclosed