SCHEMBL20000626

SCHEMBL20000626

CCNC(=O)C(C)c1ccc(OC2CCN(c3nc(C)ccc3F)C2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 20/20 1.00

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
SCHEMBL16255334 1.00 ACACB (1.00) ACACB
SCHEMBL16255307 0.86 ACACB (1.00) ACACB
SCHEMBL16253320 0.85 ACACB (1.00) ACACB
SCHEMBL16255280 0.85 ACACB (1.00) ACACB
SCHEMBL16255364 0.84 ACACB (1.00) ACACB
SCHEMBL16240471 0.84 ACACB (0.85) ACACB
SCHEMBL16240469 0.84 ACACB (0.85) ACACB
SCHEMBL16255316 0.82 ACACB (1.00) ACACB
SCHEMBL16214373 0.82 ACACB (1.00) ACACB
SCHEMBL16255358 0.82 ACACB (1.00) ACACB

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-2997024-B1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF BOEHRINGER INGELHEIM INT (DE) 2018-03-28 — — EP disclosed
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