SCHEMBL27505307

SCHEMBL27505307

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4C(C)(C)CCC[C@]4(C)[C@H]3[C@H](O)C[C@]12C

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 14/20 0.57
▸ CDC25B P30305 12/20 0.57
▸ NPC1L1 Q9UHC9 3/20 0.48
▸ MEN1 O00255 1/20 0.47
▸ USP2 O75604 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ INPP5D Q92835 1/20 0.44

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
SCHEMBL27506459 0.84 CDC25A (0.52) CDC25ACDC25BNPC1L1MEN1USP2
SCHEMBL27506460 0.83 CYP2D6 (0.61) CDC25ACDC25BNPC1L1MEN1USP2
SCHEMBL6559019 0.81 CDC25A (0.62) CDC25ACDC25BNPC1L1MEN1USP2
SCHEMBL16226151 0.79 OSBP (0.59) NPC1L1MEN1USP2LMNATP53
SCHEMBL6558598 0.79 OSBP (0.59) NPC1L1MEN1USP2LMNATP53
SCHEMBL27241194 0.73 CDC25A (0.83) CDC25ACDC25BNPC1L1MEN1USP2
SCHEMBL27241192 0.73 CDC25A (0.83) CDC25ACDC25BNPC1L1MEN1USP2
SCHEMBL16713993 0.73 OSBP (0.57) CDC25ACDC25BNPC1L1USP2LMNA
SCHEMBL27507701 0.73 OSBP (0.57) CDC25ACDC25BNPC1L1USP2LMNA
SCHEMBL27507702 0.73 OSBP (0.57) CDC25ACDC25BNPC1L1USP2LMNA

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
CN-1242017-A Meiosis regulating compounds NOVO NORDISK AS (DK) 2000-01-19 — — CN disclosed
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