SCHEMBL9217708

SCHEMBL9217708

CC1(C(=O)[O-])C=Cc2cccc(O)c2N1.CC1(C(=O)[O-])C=Cc2cccc(O)c2N1.[Mn+2]

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
THRB P10828 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
SCHEMBL8321058 0.97 THRB (0.30) THRB
Lithium Ion SCHEMBL30093254 0.97 THRB (0.30) THRB
SCHEMBL1155361 0.97 THRB (0.30) THRB
SCHEMBL1155647 0.94
Lithium Ion SCHEMBL17924045 0.76
Zinc Ion SCHEMBL6829961 0.76 P2RX4 (0.30)
SCHEMBL4456748 0.76 ADAMTS4 (0.30)
SCHEMBL1232231 0.74
SCHEMBL3208190 0.74 MAPT (0.38)
Lithium Ion SCHEMBL984533 0.74 MAPT (0.38)

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-5401492-A Imaging organs rich in mitochondria STERLING WINTHROP, INC. (US) 1995-03-28 US disclosed