SCHEMBL9010519

SCHEMBL9010519

C[C@@H](CCCC(C)(C)C)[C@H]1CC[C@H]2[C@@H](O)CCC[C@]12C

nearest known ligand 0.76

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 8/20 0.76
▸ CDC25B P30305 6/20 0.76
▸ OSBP P22059 1/20 0.48
▸ OSBP2 Q969R2 1/20 0.48
▸ VDR P11473 1/20 0.45
▸ GPBAR1 Q8TDU6 2/20 0.45
▸ NR1H4 Q96RI1 1/20 0.45
▸ GPR183 P32249 1/20 0.43
▸ NPC1L1 Q9UHC9 1/20 0.43

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
SCHEMBL14371762 0.91 CDC25A (0.74) CDC25ACDC25BOSBPOSBP2VDR
SCHEMBL29067231 0.91 CDC25A (0.74) CDC25ACDC25BOSBPOSBP2VDR
SCHEMBL26322309 0.91 CDC25A (0.74) CDC25ACDC25BOSBPOSBP2VDR
SCHEMBL14107828 0.91 CDC25A (0.74) CDC25ACDC25BOSBPOSBP2VDR
SCHEMBL26324654 0.91 CDC25A (0.74) CDC25ACDC25BOSBPOSBP2VDR
SCHEMBL17888102 0.91 CDC25A (0.74) CDC25ACDC25BOSBPOSBP2VDR
SCHEMBL7763377 0.86 CDC25A (0.67) CDC25ACDC25BOSBPOSBP2GPBAR1
SCHEMBL9777571 0.86 CDC25A (0.67) CDC25ACDC25BOSBPOSBP2GPR183
SCHEMBL7764764 0.86 CDC25A (0.67) CDC25ACDC25BOSBPOSBP2GPBAR1
SCHEMBL9777599 0.86 CDC25A (0.67) CDC25ACDC25BOSBPOSBP2GPR183

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-8188064-B2 Reducing cell differentiation of adipocyte; reducing body fat WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2012-05-29 — — US disclosed
US-8188064-B2 Reducing cell differentiation of adipocyte; reducing body fat WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2012-05-29 — — US disclosed
EP-1641466-B1 2-METHYLENE-19-NOR-20(S)-25-METHYL-1ALPHA-HYDROXYCALCIFEROL AND ITS USES WISCONSIN ALUMNI RES FOUND (US) 2007-01-03 — — EP disclosed
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