SCHEMBL5062306

SCHEMBL5062306

C[C@H](NC(=O)O)C(CCCO)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 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
SCHEMBL25322031 0.91 TRPV1 (0.33) TRPV1
SCHEMBL17913542 0.91 TRPV1 (0.33) TRPV1
SCHEMBL25322033 0.91 TRPV1 (0.33) TRPV1
SCHEMBL17913529 0.84 TRPV1 (0.33) TRPV1
SCHEMBL13303252 0.79 ATM (0.48)
SCHEMBL26926783 0.78
SCHEMBL15573718 0.77 CYP2D6 (0.33)
SCHEMBL3274415 0.77
SCHEMBL5063745 0.77
SCHEMBL26782892 0.76 ATM (0.47)

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-1911743-A1 CYCLIC AMINE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-04-16 EP disclosed