SCHEMBL30714764

SCHEMBL30714764

CNCCOC(=O)/C=C1\CC[C@H]2[C@@H]([C@@H](O)C[C@@H]3[C@]2(C)CCC[C@]3(C)C(=O)OC)[C@H]1C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATP1A1 P05023 1/20 0.41
ATP1B1 P05026 1/20 0.41
ATP1A3 P13637 1/20 0.41
ATP1B2 P14415 1/20 0.41
ATP1A2 P50993 1/20 0.41
ATP1B3 P54709 1/20 0.41
FXYD2 P54710 1/20 0.41
ATP1A4 Q13733 1/20 0.41
ATP12A P54707 1/20 0.41
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
HSP90AA1 P07900 1/20 0.33
ATM Q13315 1/20 0.32
SOD1 P00441 1/20 0.32
POLA1 P09884 2/20 0.31

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
SCHEMBL309088 1.00 ATP1A1 (0.41) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL1650207 1.00 ATP1A1 (0.41) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL309087 1.00 ATP1A1 (0.41) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL31237867 0.82 ATP1A1 (0.47) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL27886000 0.75 ATP1A1 (0.45) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL3134704 0.73 ATP12A (0.69) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL4148208 0.71 ATP1A1 (0.73) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL6857605 0.71 ATP1A1 (0.73) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL30505265 0.71 ATP1A1 (0.73) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL6857608 0.71 ATP1A1 (0.73) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250283041-A1 METHODS FOR PRODUCING RED BLOOD CELLS ALBERT EINSTEIN COLLEGE MEDICINE (US) 2025-09-11 US disclosed
EP-4532693-A1 METHODS FOR PRODUCING RED BLOOD CELLS Albert Einstein College of Medicine (US) 2025-04-09 EP disclosed
WO-2023230405-A1 METHODS FOR PRODUCING RED BLOOD CELLS ALBERT EINSTEIN COLLEGE OF MEDICINE (US) 2023-11-30 WO disclosed