SCHEMBL19835162

SCHEMBL19835162

CNC(C)C(=O)NC1CCc2ccc(OCCCc3ccccc3)cc2N(Cc2ccccc2)C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
XIAP P98170 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
SCHEMBL19847689 1.00 XIAP (1.00) XIAP
SCHEMBL15427578 1.00 XIAP (1.00) XIAP
SCHEMBL19835161 1.00 XIAP (1.00) XIAP
Hydrochloric Acid SCHEMBL15414531 0.99 XIAP (0.98) XIAP
Hydrochloric Acid SCHEMBL15414530 0.99 XIAP (0.98) XIAP
SCHEMBL15427521 0.96 XIAP (1.00) XIAP
SCHEMBL19835083 0.96 XIAP (1.00) XIAP
SCHEMBL19847723 0.96 XIAP (1.00) XIAP
SCHEMBL19835085 0.96 XIAP (1.00) XIAP
Hydrochloric Acid SCHEMBL15413695 0.95 XIAP (0.98) XIAP

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-2872490-B1 ANTIPROLIFERATIVE BENZO[B]AZEPIN-2-ONES HOFFMANN LA ROCHE (CH) 2018-02-07 EP claimed