SCHEMBL8975401

SCHEMBL8975401

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nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31

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
SCHEMBL28169132 0.83 ALDH1A1 (0.38) TSHR
SCHEMBL925174 0.83 TP53 (0.33)
SCHEMBL15441341 0.81 TP53 (0.32)
SCHEMBL28965388 0.79 ALDH1A1 (0.36)
SCHEMBL8234 0.78 TP53 (0.36) TSHR
SCHEMBL27535191 0.76 TP53 (0.35) TSHR
Ammonia Solution, Strong SCHEMBL11684313 0.74 TSHR (0.37) TSHR
SCHEMBL28965422 0.74 ALDH1A1 (0.58)
SCHEMBL27671545 0.74 TP53 (0.33) TSHR
SCHEMBL9305101 0.74 TSHR (0.42) TSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0705345-A1 PROCESS FOR THE PREPARATION OF PYRUVIC ACID E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-04-10 EP disclosed
WO-1995000656-A1 PROCESS FOR THE PREPARATION OF PYRUVIC ACID E.I. DU PONT DE NEMOURS AND COMPANY (US) 1995-01-05 WO disclosed