SCHEMBL19783228

SCHEMBL19783228

CC(CO)Oc1nc2sc(Cl)nc2cc1F

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACACB O00763 9/20 0.35
ALOX5AP P20292 4/20 0.33
FEN1 P39748 4/20 0.33
BRAF P15056 1/20 0.32
KMT2A Q03164 1/20 0.30

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
SCHEMBL19783061 0.86 ACACB (0.36) ACACB
SCHEMBL19782765 0.84 ALOX5AP (0.37) ACACBALOX5APFEN1BRAF
SCHEMBL19783177 0.83 ACACB (0.39) ACACB
SCHEMBL19783176 0.83 ACACB (0.39) ACACB
SCHEMBL21379681 0.83 ACACB (0.33) ACACB
SCHEMBL19783231 0.83 ACACB (0.33) ACACB
SCHEMBL30189752 0.83 ACACB (0.33) ACACB
SCHEMBL21379514 0.79 ACACB (0.39) ACACBKMT2A
SCHEMBL30189708 0.79 ACACB (0.39) ACACBKMT2A
SCHEMBL21379513 0.79 ACACB (0.39) ACACBKMT2A

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
WO-2018013774-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-01-18 WO disclosed