SCHEMBL14159019

SCHEMBL14159019

OC1CCC(C2CC(C3CCC(O)CC3)C2)CC1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
EPHX2 P34913 1/20 0.33
SHBG P04278 1/20 0.32

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
SCHEMBL26663722 0.89
SCHEMBL7077398 0.89 TSHR (0.50) TSHREPHX2SHBG
SCHEMBL10879751 0.89 TSHR (0.50) TSHREPHX2SHBG
SCHEMBL7799823 0.89 TSHR (0.50) TSHREPHX2SHBG
SCHEMBL219048 0.89 TSHR (0.50) TSHREPHX2SHBG
SCHEMBL4569171 0.87 TSHR (0.37) TSHREPHX2
SCHEMBL3334537 0.86 LMNA (0.35) TSHR
SCHEMBL16625921 0.84 TSHR (0.42) TSHR
SCHEMBL18030980 0.83 LMNA (0.33) TSHR
SCHEMBL29674170 0.83

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-1418047-B1 Planographic printing plate precursor FUJIFILM CORP (JP) 2008-06-11 EP disclosed