SCHEMBL6706039

SCHEMBL6706039

CC(CO)CCC[C@@H](C)[C@H]1CC[C@H]2C3(O)CCC4CCCC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 9/20 0.49
▸ CDC25B P30305 9/20 0.49
▸ INPP5D Q92835 1/20 0.47
▸ AKR1B10 O60218 1/20 0.41
▸ AKR1B1 P15121 1/20 0.41
▸ EFNA1 P20827 1/20 0.41
▸ EPHA2 P29317 1/20 0.41
▸ PSEN1 P49768 1/20 0.41
▸ PSEN2 P49810 1/20 0.41
▸ GPBAR1 Q8TDU6 1/20 0.41
▸ APH1B Q8WW43 1/20 0.41
▸ NCSTN Q92542 1/20 0.41
▸ APH1A Q96BI3 1/20 0.41
▸ PSENEN Q9NZ42 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ PTPN1 P18031 1/20 0.40

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
SCHEMBL5406429 0.88 INPP5D (0.47) CDC25ACDC25BINPP5DAKR1B10AKR1B1
SCHEMBL3225451 0.87 CDC25A (0.41) CDC25ACDC25BINPP5DAKR1B10AKR1B1
SCHEMBL15536784 0.85 VDR (0.48) CDC25ACDC25BINPP5DOSBP
SCHEMBL15536787 0.85 VDR (0.48) CDC25ACDC25BINPP5DOSBP
SCHEMBL17825552 0.84 PTPN1 (0.45) CDC25ACDC25BINPP5DAKR1B10AKR1B1
SCHEMBL17912309 0.77 EPHA2 (0.68) CDC25AINPP5DAKR1B10AKR1B1EFNA1
SCHEMBL28093234 0.77 EPHA2 (0.68) CDC25AINPP5DAKR1B10AKR1B1EFNA1
SCHEMBL3447578 0.77 EPHA2 (0.68) CDC25AINPP5DAKR1B10AKR1B1EFNA1
SCHEMBL133953 0.77 EPHA2 (0.68) CDC25AINPP5DAKR1B10AKR1B1EFNA1
SCHEMBL30575186 0.77 EPHA2 (0.68) CDC25AINPP5DAKR1B10AKR1B1EFNA1

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
US-20040121992-A1 Therapeutic methods of reducing cholesterol accumulation NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2004-06-24 — — US disclosed
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