SCHEMBL7164661

SCHEMBL7164661

C=C1C(=CC=C2CCC[C@]3(C)C([C@H](C)SCCC(C)(C)O)=CC[C@@H]23)C[C@@H](O[Si](C)(C)C(C)(C)C)C[C@@H]1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP24A1 Q07973 3/20 0.45
VDR P11473 3/20 0.44
CYP27B1 O15528 1/20 0.39

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
SCHEMBL7164658 1.00 CYP24A1 (0.45) CYP24A1VDRCYP27B1
SCHEMBL7162102 0.90 CYP24A1 (0.46) CYP24A1VDRCYP27B1
SCHEMBL7208688 0.90 CYP24A1 (0.46) CYP24A1VDRCYP27B1
SCHEMBL7162105 0.90 CYP24A1 (0.46) CYP24A1VDRCYP27B1
SCHEMBL7162545 0.89 CYP24A1 (0.45) CYP24A1VDRCYP27B1
SCHEMBL7161812 0.89 CYP24A1 (0.45) CYP24A1VDRCYP27B1
SCHEMBL7162548 0.89 CYP24A1 (0.45) CYP24A1VDRCYP27B1
SCHEMBL7161814 0.89 CYP24A1 (0.45) CYP24A1VDRCYP27B1
SCHEMBL7165878 0.89 CYP24A1 (0.45) CYP24A1VDRCYP27B1
SCHEMBL7166656 0.89 CYP24A1 (0.45) CYP24A1VDRCYP27B1

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-0947504-B1 16-ENE-VITAMIN D DERIVATIVES CHUGAI PHARMACEUTICAL CO LTD (JP) 2003-09-03 EP disclosed
US-6555699-B2 Antitumor and antirheumatic agents, high binding affinity CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-04-29 US disclosed
US-20020193616-A1 16-ENE-VITAMIN D DERIVATIVES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-12-19 US disclosed
US-6326503-B1 ANTITUMOR AGENTS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2001-12-04 US disclosed
US-6184398-B1 ANTITUMOR AGENTS AND TREATMENT OF RHEUMATIC CONDITIONS; HIGH BINDING ABILITY TO VITAMIN D RECEPTORS AND WEAK HYPERCALCEMIC ACTIVITY; E.G.,1,3-DIHYDROXY-20-3-HYDROXY-3-METHYLBUTYLTHIO)-9,10-SECOPREGNA -5,7,10(19),16-TETRAENE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2001-02-06 US disclosed
EP-0947504-A1 16-ENE-VITAMIN D DERIVATIVES Chugai Seiyaku Kabushiki Kaisha (JP) 1999-10-06 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-20020193616-A1 16-ENE-VITAMIN D DERIVATIVES VDR, CYP24A1, CYP2R1 CYP24A1 2/4885VDR 1/4885CYP27B1 4/4885

“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.