SCHEMBL24159249

SCHEMBL24159249

COCC12CC(NC(C)=O)(C1)C2

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.38
RXFP1 Q9HBX9 1/20 0.32
MEN1 O00255 1/20 0.30
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
SCHEMBL21626318 0.81 GAA (0.36) GAA
SCHEMBL24458979 0.78 GAA (0.37) GAA
SCHEMBL31637495 0.77 ALDH1A1 (0.35) GAA
SCHEMBL23225441 0.77 FOLH1 (0.38) GAAMEN1KMT2A
SCHEMBL21452653 0.75
SCHEMBL16118629 0.75 KDM4E (0.37) GAA
SCHEMBL11224012 0.75 KDM4E (0.37) GAA
SCHEMBL24458540 0.73 IDO1 (0.30)
SCHEMBL21452570 0.73 ALDH1A1 (0.30)
SCHEMBL24159127 0.72 ALDH1A1 (0.33) GAA

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-3793565-B1 MCL-1 INHIBITORS GILEAD SCIENCES INC (US) 2022-01-05 EP disclosed