SCHEMBL18776183

SCHEMBL18776183

C=C(C)C(=O)OCCOC(=O)NC1CC(C)(C)CC(C)(CNC(=O)CCOC(=O)NCC2(C)CC(C)CC(C)(C)C2)C1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
EPHX1 P07099 1/20 0.38

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
SCHEMBL17658796 0.95 TSHR (0.56) TSHREPHX1
SCHEMBL25993934 0.89 TSHR (0.63) TSHREPHX1
SCHEMBL11900914 0.89 TSHR (0.63) TSHREPHX1
SCHEMBL410889 0.87 TSHR (0.46) TSHREPHX1
SCHEMBL18193278 0.87 TSHR (0.47) TSHREPHX1
SCHEMBL18193277 0.86 TSHR (0.57) TSHREPHX1
SCHEMBL18123399 0.86 TSHR (0.59) TSHREPHX1
SCHEMBL18123485 0.86 TSHR (0.59) TSHREPHX1
SCHEMBL18193272 0.85 TSHR (0.58) TSHREPHX1
SCHEMBL21034804 0.85 TSHR (0.61) TSHREPHX1

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-20170112607-A1 MULTIPURPOSE IMPLANT WITH MODELED SURFACE STRUCTURE FOR SOFT TISSUE RECONSTRUCTION IconLab USA, Inc. 2017-04-27 US disclosed