SCHEMBL4765697

SCHEMBL4765697

CCN1C(=O)OC2(CCCN(C3CCN(C(=O)c4c(NC(=O)O)sc5ccccc45)CC3)C2)C1=O

nearest known ligand 0.88

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACACB O00763 20/20 0.88
ACACA Q13085 19/20 0.88

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
SCHEMBL3498286 0.93 ACACB (1.00) ACACBACACA
SCHEMBL3497817 0.93 ACACB (0.88) ACACBACACA
SCHEMBL3495822 0.92 ACACB (1.00) ACACBACACA
SCHEMBL13312514 0.91 ACACB (0.82) ACACBACACA
SCHEMBL3498088 0.88 ACACB (0.80) ACACBACACA
SCHEMBL3496588 0.88 ACACB (0.89) ACACBACACA
SCHEMBL3496429 0.87 ACACB (0.79) ACACBACACA
SCHEMBL3497657 0.84 ACACB (0.69) ACACBACACA
SCHEMBL3496873 0.84 ACACB (0.85) ACACBACACA
SCHEMBL4724597 0.84 ACACB (0.89) ACACBACACA

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-1911753-A1 SPIRO-CYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-04-16 EP disclosed