SCHEMBL11147752

SCHEMBL11147752

CCCCCCCC[Sn+3].O=C([O-])C(CS)C1CCCCC1.O=C([O-])C(CS)C1CCCCC1.O=C([O-])C(CS)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
EPHX1 P07099 9/20 0.38
EPHX2 P34913 2/20 0.38
NAAA Q02083 3/20 0.36
CA2 P00918 1/20 0.34
CPN1 P15169 2/20 0.34
CPB2 Q96IY4 2/20 0.34

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
SCHEMBL11149906 0.83 TSHR (0.39) TSHREPHX1EPHX2NAAACA2
Lithium Ion SCHEMBL4370616 0.71 CPN1 (0.47) CPN1CPB2
SCHEMBL6436049 0.70 SHBG (0.45) EPHX1EPHX2CA2
SCHEMBL6435909 0.70 SHBG (0.45) EPHX1EPHX2CA2
SCHEMBL6434886 0.70 SHBG (0.45) EPHX1EPHX2CA2
SCHEMBL3421978 0.70 SHBG (0.45) TSHREPHX1EPHX2CA2
Lithium Ion SCHEMBL3888071 0.70 SHBG (0.45) EPHX1EPHX2CA2
SCHEMBL6436533 0.70 SHBG (0.45) EPHX1EPHX2CA2
SCHEMBL6434336 0.70 SHBG (0.45) EPHX1EPHX2CA2
SCHEMBL6435945 0.70 SHBG (0.45) EPHX1EPHX2CA2

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-4402887-A CALENDERING WITH PLASTICIZER, PHOTOSENSITIZER, STABILIZERS, AND POLYMERIZATION INHIBITOR, THEN IRRADIATING WITH ULTRAUIOLET RADIATION DAINIPPON INK AND CHEMICALS INC. (JP) 1983-09-06 US disclosed