SCHEMBL17207128

SCHEMBL17207128

CCCOc1ccc(N2CCC(Oc3ccc([C@H](C)NC(C)=O)cc3)C2)c(OC)c1

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
SCHEMBL15048037 0.93 ACACB (1.00) ACACB
SCHEMBL17207021 0.90 ACACB (1.00) ACACB
SCHEMBL16481295 0.90 ACACB (1.00) ACACB
SCHEMBL16481279 0.90 ACACB (1.00) ACACB
SCHEMBL17207146 0.90 ACACB (1.00) ACACB
SCHEMBL16481165 0.89 ACACB (1.00) ACACB
SCHEMBL17207043 0.89 ACACB (1.00) ACACB
SCHEMBL17207059 0.87 ACACB (1.00) ACACB
SCHEMBL17207097 0.86 ACACB (1.00) ACACB
SCHEMBL16481116 0.86 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
US-9169205-B2 Pyrrolidine derivatives, pharmaceutical compositions and uses thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-10-27 US disclosed