SCHEMBL19783224

SCHEMBL19783224

O=C(Cl)OCCOc1nc2sc(Cl)nc2cc1F

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACACB O00763 9/20 0.36
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL19783785 0.89 ACACB (0.37) ACACBKDM4E
SCHEMBL19783052 0.83 ACACB (0.32) ACACB
SCHEMBL19782470 0.80 F2RL3 (0.37)
SCHEMBL19783177 0.79 ACACB (0.39) ACACB
SCHEMBL19783176 0.79 ACACB (0.39) ACACB
SCHEMBL21379587 0.79 ACACB (0.41) ACACB
SCHEMBL19783222 0.79 ACACB (0.41) ACACB
SCHEMBL19783303 0.76 ACACB (0.38) ACACB
SCHEMBL21379475 0.75 KMT2A (0.35) ACACB
SCHEMBL21379513 0.74 ACACB (0.39) 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
WO-2018013774-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-01-18 WO disclosed