SCHEMBL4323719

SCHEMBL4323719

CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC[C@H]4CC(OCCCO)CC[C@]4(C)C3CC[C@@]21C

nearest known ligand 0.75

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 4/20 0.75
POLA1 P09884 1/20 0.75
CYP2D6 P10635 1/20 0.65
CYP2C19 P33261 1/20 0.65
INPP5D Q92835 1/20 0.64
FOLH1 Q04609 2/20 0.62
ST6GAL1 P15907 3/20 0.58
VDR P11473 3/20 0.55
USP2 O75604 1/20 0.55
OSBP P22059 1/20 0.54
OSBP2 Q969R2 1/20 0.54
ABCC4 O15439 1/20 0.54
NPC1L1 Q9UHC9 1/20 0.52

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
SCHEMBL13266898 1.00 CDC25A (0.75) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL12695628 1.00 CDC25A (0.75) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL875595 0.95 CDC25A (0.76) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL17123434 0.95 CDC25A (0.76) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL19009189 0.95 CDC25A (0.76) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL19009194 0.91 CDC25A (0.73) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL2508826 0.90 CDC25A (0.72) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL4315337 0.90 CDC25A (0.72) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL2508823 0.90 CDC25A (0.72) CDC25APOLA1CYP2D6CYP2C19INPP5D
SCHEMBL12086538 0.90 CDC25A (0.74) CDC25APOLA1CYP2D6CYP2C19INPP5D

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-7569706-B2 Glycerol derivative KYOWA HAKKO KIRIN CO., LTD. (JP) 2009-08-04 US disclosed
US-20050208015-A1 Glycerol derivative TECNO NETWORK SHIKOKU CO., LTD (JP) 2005-09-22 US disclosed
EP-1550651-A1 GLYCEROL DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2005-07-06 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050208015-A1 Glycerol derivative GK, GLS, GLS2 CDC25A 1285/4885POLA1 2312/4885CYP2D6 4219/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.