SCHEMBL7763377

SCHEMBL7763377

C[C@H](CCC[C@](C)(O)C(=O)O)[C@H]1CCC2C(O)CCC[C@@]21C

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 4/20 0.67
▸ CDC25B P30305 2/20 0.67
▸ OSBP P22059 1/20 0.47
▸ OSBP2 Q969R2 1/20 0.47
▸ GPBAR1 Q8TDU6 5/20 0.46
▸ NR1H4 Q96RI1 2/20 0.46
▸ AKR1B10 O60218 1/20 0.43
▸ AKR1B1 P15121 1/20 0.43
▸ EFNA1 P20827 1/20 0.43
▸ EPHA2 P29317 1/20 0.43
▸ PSEN1 P49768 1/20 0.43
▸ PSEN2 P49810 1/20 0.43
▸ APH1B Q8WW43 1/20 0.43
▸ NCSTN Q92542 1/20 0.43
▸ APH1A Q96BI3 1/20 0.43
▸ PSENEN Q9NZ42 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ HSD17B10 Q99714 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
SCHEMBL7764764 1.00 CDC25A (0.67) CDC25ACDC25BOSBPOSBP2GPBAR1
SCHEMBL7764767 1.00 CDC25A (0.67) CDC25ACDC25BOSBPOSBP2GPBAR1
SCHEMBL7763381 1.00 CDC25A (0.67) CDC25ACDC25BOSBPOSBP2GPBAR1
SCHEMBL26324654 0.88 CDC25A (0.74) CDC25ACDC25BOSBPOSBP2NPC1L1
SCHEMBL17888102 0.88 CDC25A (0.74) CDC25ACDC25BOSBPOSBP2NPC1L1
SCHEMBL14371762 0.88 CDC25A (0.74) CDC25ACDC25BOSBPOSBP2NPC1L1
SCHEMBL14107828 0.88 CDC25A (0.74) CDC25ACDC25BOSBPOSBP2NPC1L1
SCHEMBL29067231 0.88 CDC25A (0.74) CDC25ACDC25BOSBPOSBP2NPC1L1
SCHEMBL26322309 0.88 CDC25A (0.74) CDC25ACDC25BOSBPOSBP2NPC1L1
SCHEMBL9010519 0.86 CDC25A (0.76) CDC25ACDC25BOSBPOSBP2GPBAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0854138-B1 Vitamin D3 derivative and production process thereof TEIJIN LTD (JP) 2001-05-23 — — EP disclosed
US-6177586-B1 USEFUL AS A PHARMACEUTICAL SUCH AS AN AGENT FOR PROMOTING BONE FORMATION, AN AGENT FOR SUPPRESSING PROLIFERATION OF TUMOR CELLS, AN AGENT FOR HIGH CALCIUM BLOOD DISEASES, AND AN IMMUNOSUPPRESSION AGENT TEIJIN LIMITED (JP) 2001-01-23 — — US disclosed
US-5986112-A STEROID DERIVATIVES AS ANTITUMOR AGENTS AND BLOOD METAL CONCENTRATES TEIJIN LIMITED (JP) 1999-11-16 — — US disclosed
EP-0854138-A2 Vitamin D3 derivative and production process thereof TEIJIN LIMITED (JP) 1998-07-22 — — EP disclosed
US-5719297-A Vitamin D3 derivatives and production process thereof TEIJIN LIMITED (JP) 1998-02-17 — — US disclosed
EP-0712843-A1 VITAMIN D3 DERIVATIVE AND PROCESS FOR PRODUCING THE SAME TEIJIN LIMITED (JP) 1996-05-22 — — EP disclosed
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