SCHEMBL20000620

SCHEMBL20000620

CCNC(=O)C(C)c1ccc(OC2CCN(c3ccc(OCC4CC4)cc3)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
SCHEMBL16255268 1.00 ACACB (1.00) ACACB
SCHEMBL16255333 0.96 ACACB (1.00) ACACB
SCHEMBL20000535 0.91 ACACB (1.00) ACACB
SCHEMBL16235583 0.91 ACACB (1.00) ACACB
SCHEMBL16255305 0.91 ACACB (1.00) ACACB
SCHEMBL16255306 0.90 ACACB (1.00) ACACB
SCHEMBL16255175 0.90 ACACB (1.00) ACACB
SCHEMBL16235542 0.88 ACACB (1.00) ACACB
SCHEMBL16255176 0.88 ACACB (1.00) ACACB
SCHEMBL16235540 0.88 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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